N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide

C119H127Cl4N17O10 — CID 158524997

IUPACN-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide
SMILESCC(C)N(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)N(C)c1cc(Cl)cc(Cl)c1.CCOc1cccc(C(=O)NCc2cccc(-c3cn4c(n3)CCC4)c2)c1.CN(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)Nc1cc(Cl)cc(Cl)c1.COc1cccc(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2OC)CC2CC2)c1.COc1cccc(C(=O)N(Cc2cc(OC)cc(-c3cn4c(n3)CCC4)c2)CC2CC2)c1
InChIInChI=1S/2C26H29N3O3.C24H26Cl2N4O.C22H23N3O2.C21H20Cl2N4O/c1-31-22-6-3-5-20(14-22)26(30)29(15-18-8-9-18)16-21-13-19(10-11-24(21)32-2)23-17-28-12-4-7-25(28)27-23;1-31-22-6-3-5-20(13-22)26(30)29(15-18-8-9-18)16-19-11-21(14-23(12-19)32-2)24-17-28-10-4-7-25(28)27-24;1-16(2)30(24(31)28(3)21-12-19(25)11-20(26)13-21)14-17-6-4-7-18(10-17)22-15-29-9-5-8-23(29)27-22;1-2-27-19-9-4-8-18(13-19)22(26)23-14-16-6-3-7-17(12-16)20-15-25-11-5-10-21(25)24-20;1-26(21(28)24-18-10-16(22)9-17(23)11-18)12-14-4-2-5-15(8-14)19-13-27-7-3-6-20(27)25-19/h3,5-6,10-11,13-14,17-18H,4,7-9,12,15-16H2,1-2H3;3,5-6,11-14,17-18H,4,7-10,15-16H2,1-2H3;4,6-7,10-13,15-16H,5,8-9,14H2,1-3H3;3-4,6-9,12-13,15H,2,5,10-11,14H2,1H3,(H,23,26);2,4-5,8-11,13H,3,6-7,12H2,1H3,(H,24,28)
InChIKeyHMRLHKXPNAFOLN-UHFFFAOYSA-N
MW2097.25 g/mol
LogP24.69
Rot. Bonds31

About N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide

N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide (PubChem CID 158524997) has the molecular formula C119H127Cl4N17O10 and a molecular weight of 2097.25 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide
PubChem CID158524997
Molecular FormulaC119H127Cl4N17O10
Molecular Weight2097.25 g/mol
Exact Mass2093.87
IUPAC NameN-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide
SMILESCC(C)N(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)N(C)c1cc(Cl)cc(Cl)c1.CCOc1cccc(C(=O)NCc2cccc(-c3cn4c(n3)CCC4)c2)c1.CN(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)Nc1cc(Cl)cc(Cl)c1.COc1cccc(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2OC)CC2CC2)c1.COc1cccc(C(=O)N(Cc2cc(OC)cc(-c3cn4c(n3)CCC4)c2)CC2CC2)c1
InChIInChI=1S/2C26H29N3O3.C24H26Cl2N4O.C22H23N3O2.C21H20Cl2N4O/c1-31-22-6-3-5-20(14-22)26(30)29(15-18-8-9-18)16-21-13-19(10-11-24(21)32-2)23-17-28-12-4-7-25(28)27-23;1-31-22-6-3-5-20(13-22)26(30)29(15-18-8-9-18)16-19-11-21(14-23(12-19)32-2)24-17-28-10-4-7-25(28)27-24;1-16(2)30(24(31)28(3)21-12-19(25)11-20(26)13-21)14-17-6-4-7-18(10-17)22-15-29-9-5-8-23(29)27-22;1-2-27-19-9-4-8-18(13-19)22(26)23-14-16-6-3-7-17(12-16)20-15-25-11-5-10-21(25)24-20;1-26(21(28)24-18-10-16(22)9-17(23)11-18)12-14-4-2-5-15(8-14)19-13-27-7-3-6-20(27)25-19/h3,5-6,10-11,13-14,17-18H,4,7-9,12,15-16H2,1-2H3;3,5-6,11-14,17-18H,4,7-10,15-16H2,1-2H3;4,6-7,10-13,15-16H,5,8-9,14H2,1-3H3;3-4,6-9,12-13,15H,2,5,10-11,14H2,1H3,(H,23,26);2,4-5,8-11,13H,3,6-7,12H2,1H3,(H,24,28)
InChIKeyHMRLHKXPNAFOLN-UHFFFAOYSA-N
XLogP24.69
TPSA260.86 Ų
H-Bond Donors2
H-Bond Acceptors20
Rotatable Bonds31
Heavy Atoms150
Complexity

Lipinski Rule of Five

3 violations

RuleValue
MW ≤ 5002097.25
LogP ≤ 524.69
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 1020

Analyze N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide with MolForge

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide?
The IUPAC name of N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide (CID 158524997) is N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide.
What is the SMILES notation for N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide?
The canonical SMILES for N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide is CC(C)N(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)N(C)c1cc(Cl)cc(Cl)c1.CCOc1cccc(C(=O)NCc2cccc(-c3cn4c(n3)CCC4)c2)c1.CN(Cc1cccc(-c2cn3c(n2)CCC3)c1)C(=O)Nc1cc(Cl)cc(Cl)c1.COc1cccc(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2OC)CC2CC2)c1.COc1cccc(C(=O)N(Cc2cc(OC)cc(-c3cn4c(n3)CCC4)c2)CC2CC2)c1.
What is the InChIKey of N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide?
The InChIKey is HMRLHKXPNAFOLN-UHFFFAOYSA-N. The full InChI is InChI=1S/2C26H29N3O3.C24H26Cl2N4O.C22H23N3O2.C21H20Cl2N4O/c1-31-22-6-3-5-20(14-22)26(30)29(15-18-8-9-18)16-21-13-19(10-11-24(21)32-2)23-17-28-12-4-7-25(28)27-23;1-31-22-6-3-5-20(13-22)26(30)29(15-18-8-9-18)16-19-11-21(14-23(12-19)32-2)24-17-28-10-4-7-25(28)27-24;1-16(2)30(24(31)28(3)21-12-19(25)11-20(26)13-21)14-17-6-4-7-18(10-17)22-15-29-9-5-8-23(29)27-22;1-2-27-19-9-4-8-18(13-19)22(26)23-14-16-6-3-7-17(12-16)20-15-25-11-5-10-21(25)24-20;1-26(21(28)24-18-10-16(22)9-17(23)11-18)12-14-4-2-5-15(8-14)19-13-27-7-3-6-20(27)25-19/h3,5-6,10-11,13-14,17-18H,4,7-9,12,15-16H2,1-2H3;3,5-6,11-14,17-18H,4,7-10,15-16H2,1-2H3;4,6-7,10-13,15-16H,5,8-9,14H2,1-3H3;3-4,6-9,12-13,15H,2,5,10-11,14H2,1H3,(H,23,26);2,4-5,8-11,13H,3,6-7,12H2,1H3,(H,24,28).
What are the key properties of N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide?
N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide has a molecular weight of 2097.25 g/mol, XLogP of 24.69, 31 rotatable bonds, 2 hydrogen bond donors, and 20 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-5-methoxyphenyl]methyl]-3-methoxybenzamide;N-(cyclopropylmethyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-methoxyphenyl]methyl]-3-methoxybenzamide;1-(3,5-dichlorophenyl)-3-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methyl-3-propan-2-ylurea;3-(3,5-dichlorophenyl)-1-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-1-methylurea;N-[[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-3-ethoxybenzamide is sourced from PubChem (CID 158524997), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).