1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one

C177H195Cl8N23O10 — CID 160546561

IUPAC1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one
SMILESCC(=O)N1CCC(CC(=O)CCc2cccc(-c3cn4c(n3)CCC4)c2)CC1.CC(C)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1OC1CCC1)C(=O)Cc1ccc(Cl)c(Cl)c1.COc1cccc(C(=O)NCc2cc(-c3cn4c(n3)CCC4)ccc2N2CCN(C)CC2)c1.Cc1ccccc1-c1ccc(-c2cn3c(n2)CCC3)cc1CNC(=O)Cc1ccc(Cl)c(Cl)c1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)CC1CCNCC1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)Cc1cccc(Cl)c1Cl.O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1N1CCCC1)CC1CC1
InChIInChI=1S/C29H32Cl2N4O.C28H31Cl2N3O2.C28H25Cl2N3O.C26H31N5O2.C23H29N3O2.C22H20Cl2N2O.C21H27N3O/c30-24-9-7-21(14-25(24)31)15-29(36)35(17-20-5-6-20)18-23-16-22(8-10-27(23)33-11-1-2-12-33)26-19-34-13-3-4-28(34)32-26;1-18(2)33(28(34)14-19-8-10-23(29)24(30)13-19)16-21-15-20(9-11-26(21)35-22-5-3-6-22)25-17-32-12-4-7-27(32)31-25;1-18-5-2-3-6-22(18)23-10-9-20(26-17-33-12-4-7-27(33)32-26)15-21(23)16-31-28(34)14-19-8-11-24(29)25(30)13-19;1-29-11-13-30(14-12-29)24-9-8-19(23-18-31-10-4-7-25(31)28-23)15-21(24)17-27-26(32)20-5-3-6-22(16-20)33-2;1-17(27)25-12-9-19(10-13-25)15-21(28)8-7-18-4-2-5-20(14-18)22-16-26-11-3-6-23(26)24-22;23-19-7-2-6-17(22(19)24)13-18(27)10-9-15-4-1-5-16(12-15)20-14-26-11-3-8-21(26)25-20;25-19(14-17-8-10-22-11-9-17)7-6-16-3-1-4-18(13-16)20-15-24-12-2-5-21(24)23-20/h7-10,14,16,19-20H,1-6,11-13,15,17-18H2;8-11,13,15,17-18,22H,3-7,12,14,16H2,1-2H3;2-3,5-6,8-11,13,15,17H,4,7,12,14,16H2,1H3,(H,31,34);3,5-6,8-9,15-16,18H,4,7,10-14,17H2,1-2H3,(H,27,32);2,4-5,14,16,19H,3,6-13,15H2,1H3;1-2,4-7,12,14H,3,8-11,13H2;1,3-4,13,15,17,22H,2,5-12,14H2
InChIKeyQXMVWEZWIYDUEF-UHFFFAOYSA-N
MW3088.28 g/mol
LogP35.50
Rot. Bonds46

About 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one

1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one (PubChem CID 160546561) has the molecular formula C177H195Cl8N23O10 and a molecular weight of 3088.28 g/mol. Its IUPAC name is 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one.

Molecular Properties

Compound Name1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one
PubChem CID160546561
Molecular FormulaC177H195Cl8N23O10
Molecular Weight3088.28 g/mol
Exact Mass3082.30
IUPAC Name1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one
SMILESCC(=O)N1CCC(CC(=O)CCc2cccc(-c3cn4c(n3)CCC4)c2)CC1.CC(C)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1OC1CCC1)C(=O)Cc1ccc(Cl)c(Cl)c1.COc1cccc(C(=O)NCc2cc(-c3cn4c(n3)CCC4)ccc2N2CCN(C)CC2)c1.Cc1ccccc1-c1ccc(-c2cn3c(n2)CCC3)cc1CNC(=O)Cc1ccc(Cl)c(Cl)c1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)CC1CCNCC1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)Cc1cccc(Cl)c1Cl.O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1N1CCCC1)CC1CC1
InChIInChI=1S/C29H32Cl2N4O.C28H31Cl2N3O2.C28H25Cl2N3O.C26H31N5O2.C23H29N3O2.C22H20Cl2N2O.C21H27N3O/c30-24-9-7-21(14-25(24)31)15-29(36)35(17-20-5-6-20)18-23-16-22(8-10-27(23)33-11-1-2-12-33)26-19-34-13-3-4-28(34)32-26;1-18(2)33(28(34)14-19-8-10-23(29)24(30)13-19)16-21-15-20(9-11-26(21)35-22-5-3-6-22)25-17-32-12-4-7-27(32)31-25;1-18-5-2-3-6-22(18)23-10-9-20(26-17-33-12-4-7-27(33)32-26)15-21(23)16-31-28(34)14-19-8-11-24(29)25(30)13-19;1-29-11-13-30(14-12-29)24-9-8-19(23-18-31-10-4-7-25(31)28-23)15-21(24)17-27-26(32)20-5-3-6-22(16-20)33-2;1-17(27)25-12-9-19(10-13-25)15-21(28)8-7-18-4-2-5-20(14-18)22-16-26-11-3-6-23(26)24-22;23-19-7-2-6-17(22(19)24)13-18(27)10-9-15-4-1-5-16(12-15)20-14-26-11-3-8-21(26)25-20;25-19(14-17-8-10-22-11-9-17)7-6-16-3-1-4-18(13-16)20-15-24-12-2-5-21(24)23-20/h7-10,14,16,19-20H,1-6,11-13,15,17-18H2;8-11,13,15,17-18,22H,3-7,12,14,16H2,1-2H3;2-3,5-6,8-11,13,15,17H,4,7,12,14,16H2,1H3,(H,31,34);3,5-6,8-9,15-16,18H,4,7,10-14,17H2,1-2H3,(H,27,32);2,4-5,14,16,19H,3,6-13,15H2,1H3;1-2,4-7,12,14H,3,8-11,13H2;1,3-4,13,15,17,22H,2,5-12,14H2
InChIKeyQXMVWEZWIYDUEF-UHFFFAOYSA-N
XLogP35.50
TPSA335.29 Ų
H-Bond Donors3
H-Bond Acceptors28
Rotatable Bonds46
Heavy Atoms218
Complexity—

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5003088.28
LogP ≤ 535.50
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 1028

Analyze 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one with MolForge

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Related Compounds

N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)acetamide;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxybenzamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-phenylphenyl]methyl]acetamide;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxy-N-methylbenzamide;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]-3-methoxybenzamide
CID 157134320
N-[[2-cyclohexyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxybenzamide
CID 134369638
N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-methoxybenzamide;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3,4-dimethoxybenzamide;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-methoxy-N-propan-2-ylbenzamide;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-phenylacetamide;(E)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-phenylprop-2-enamide;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]quinoline-8-carboxamide;1-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-5-phenylpentan-3-one
CID 159915452
4-[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-(3,4-dichlorophenyl)butan-2-one
CID 167566125
N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-phenoxyphenyl]methyl]-3-methoxybenzamide
CID 134369657
N-(dicyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-methoxybenzamide
CID 134369624
1-acetyl-N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]piperidine-3-carboxamide
CID 134369700
N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-methoxy-N-methylbenzamide
CID 134369647
N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2,6-dimethylmorpholin-4-yl)phenyl]methyl]-3-methoxy-4-methylbenzamide
CID 134369694
N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-4-methoxybenzamide
CID 134369561
(2S)-N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-phenylpropanamide
CID 134369604
N-[[4-chloro-3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3,4-dimethoxybenzamide
CID 134369592

Frequently Asked Questions

What is the IUPAC name of 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one?
The IUPAC name of 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one (CID 160546561) is 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one.
What is the SMILES notation for 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one?
The canonical SMILES for 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one is CC(=O)N1CCC(CC(=O)CCc2cccc(-c3cn4c(n3)CCC4)c2)CC1.CC(C)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1OC1CCC1)C(=O)Cc1ccc(Cl)c(Cl)c1.COc1cccc(C(=O)NCc2cc(-c3cn4c(n3)CCC4)ccc2N2CCN(C)CC2)c1.Cc1ccccc1-c1ccc(-c2cn3c(n2)CCC3)cc1CNC(=O)Cc1ccc(Cl)c(Cl)c1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)CC1CCNCC1.O=C(CCc1cccc(-c2cn3c(n2)CCC3)c1)Cc1cccc(Cl)c1Cl.O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1N1CCCC1)CC1CC1.
What is the InChIKey of 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one?
The InChIKey is QXMVWEZWIYDUEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C29H32Cl2N4O.C28H31Cl2N3O2.C28H25Cl2N3O.C26H31N5O2.C23H29N3O2.C22H20Cl2N2O.C21H27N3O/c30-24-9-7-21(14-25(24)31)15-29(36)35(17-20-5-6-20)18-23-16-22(8-10-27(23)33-11-1-2-12-33)26-19-34-13-3-4-28(34)32-26;1-18(2)33(28(34)14-19-8-10-23(29)24(30)13-19)16-21-15-20(9-11-26(21)35-22-5-3-6-22)25-17-32-12-4-7-27(32)31-25;1-18-5-2-3-6-22(18)23-10-9-20(26-17-33-12-4-7-27(33)32-26)15-21(23)16-31-28(34)14-19-8-11-24(29)25(30)13-19;1-29-11-13-30(14-12-29)24-9-8-19(23-18-31-10-4-7-25(31)28-23)15-21(24)17-27-26(32)20-5-3-6-22(16-20)33-2;1-17(27)25-12-9-19(10-13-25)15-21(28)8-7-18-4-2-5-20(14-18)22-16-26-11-3-6-23(26)24-22;23-19-7-2-6-17(22(19)24)13-18(27)10-9-15-4-1-5-16(12-15)20-14-26-11-3-8-21(26)25-20;25-19(14-17-8-10-22-11-9-17)7-6-16-3-1-4-18(13-16)20-15-24-12-2-5-21(24)23-20/h7-10,14,16,19-20H,1-6,11-13,15,17-18H2;8-11,13,15,17-18,22H,3-7,12,14,16H2,1-2H3;2-3,5-6,8-11,13,15,17H,4,7,12,14,16H2,1H3,(H,31,34);3,5-6,8-9,15-16,18H,4,7,10-14,17H2,1-2H3,(H,27,32);2,4-5,14,16,19H,3,6-13,15H2,1H3;1-2,4-7,12,14H,3,8-11,13H2;1,3-4,13,15,17,22H,2,5-12,14H2.
What are the key properties of 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one?
1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one has a molecular weight of 3088.28 g/mol, XLogP of 35.50, 46 rotatable bonds, 3 hydrogen bond donors, and 28 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(1-acetylpiperidin-4-yl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-2-(3,4-dichlorophenyl)-N-propan-2-ylacetamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-pyrrolidin-1-ylphenyl]methyl]acetamide;2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(2-methylphenyl)phenyl]methyl]acetamide;1-(2,3-dichlorophenyl)-4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]butan-2-one;N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-(4-methylpiperazin-1-yl)phenyl]methyl]-3-methoxybenzamide;4-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]-1-piperidin-4-ylbutan-2-one is sourced from PubChem (CID 160546561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).