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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile

C138H159Cl2N19O12 — CID 160516596

About 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile

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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile (PubChem CID 160516596) has the molecular formula C138H159Cl2N19O12 and a molecular weight of 2346.82 g/mol. Its IUPAC name is 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile.

Molecular Properties

• Compound Name: 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile
• PubChem CID: 160516596
• Molecular Formula: C138H159Cl2N19O12
• Molecular Weight: 2346.82 g/mol
• Exact Mass: 2344.18
• IUPAC Name: 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile
• SMILES: CC(=O)N1CCCC(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2N2CCOCC2)CC2CC2)C1.COc1cc(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2OC2CCC2)CC2CC2)ccc1C.COc1cc(C(=O)NCc2cc(-c3cn4c(n3)CCC4)ccc2N2CC(C)OC(C)C2)ccc1C.N#Cc1cccc(C(=O)CCc2cccc(-c3cn4c(n3)CCC4)c2)c1.O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1N1CCOCC1)CC1CC1
• InChI: InChI=1S/C30H35N3O3.C29H32Cl2N4O2.C29H39N5O3.C28H34N4O3.C22H19N3O/c1-20-8-11-23(16-28(20)35-2)30(34)33(17-21-9-10-21)18-24-15-22(12-13-27(24)36-25-5-3-6-25)26-19-32-14-4-7-29(32)31-26;30-24-7-5-21(14-25(24)31)15-29(36)35(17-20-3-4-20)18-23-16-22(26-19-34-9-1-2-28(34)32-26)6-8-27(23)33-10-12-37-13-11-33;1-21(35)32-10-2-4-24(18-32)29(36)34(17-22-6-7-22)19-25-16-23(26-20-33-11-3-5-28(33)30-26)8-9-27(25)31-12-14-37-15-13-31;1-18-7-8-22(13-26(18)34-4)28(33)29-14-23-12-21(24-17-31-11-5-6-27(31)30-24)9-10-25(23)32-15-19(2)35-20(3)16-32;23-14-17-5-2-7-19(13-17)21(26)10-9-16-4-1-6-18(12-16)20-15-25-11-3-8-22(25)24-20/h8,11-13,15-16,19,21,25H,3-7,9-10,14,17-18H2,1-2H3;5-8,14,16,19-20H,1-4,9-13,15,17-18H2;8-9,16,20,22,24H,2-7,10-15,17-19H2,1H3;7-10,12-13,17,19-20H,5-6,11,14-16H2,1-4H3,(H,29,33);1-2,4-7,12-13,15H,3,8-11H2
• InChIKey: QTSXHBASAZPSHZ-UHFFFAOYSA-N
• XLogP: 23.29
• TPSA: 305.40 Ų
• H-Bond Donors: 1
• H-Bond Acceptors: 26
• Rotatable Bonds: 35
• Heavy Atoms: 171
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	2346.82
LogP ≤ 5	23.29
H-Bond Donors ≤ 5	1
H-Bond Acceptors ≤ 10	26

Frequently Asked Questions

What is the IUPAC name of 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile?

The IUPAC name of 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile (CID 160516596) is 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile.

What is the SMILES notation for 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile?

The canonical SMILES for 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile is CC(=O)N1CCCC(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2N2CCOCC2)CC2CC2)C1.COc1cc(C(=O)N(Cc2cc(-c3cn4c(n3)CCC4)ccc2OC2CCC2)CC2CC2)ccc1C.COc1cc(C(=O)NCc2cc(-c3cn4c(n3)CCC4)ccc2N2CC(C)OC(C)C2)ccc1C.N#Cc1cccc(C(=O)CCc2cccc(-c3cn4c(n3)CCC4)c2)c1.O=C(Cc1ccc(Cl)c(Cl)c1)N(Cc1cc(-c2cn3c(n2)CCC3)ccc1N1CCOCC1)CC1CC1.

What is the InChIKey of 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile?

The InChIKey is QTSXHBASAZPSHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C30H35N3O3.C29H32Cl2N4O2.C29H39N5O3.C28H34N4O3.C22H19N3O/c1-20-8-11-23(16-28(20)35-2)30(34)33(17-21-9-10-21)18-24-15-22(12-13-27(24)36-25-5-3-6-25)26-19-32-14-4-7-29(32)31-26;30-24-7-5-21(14-25(24)31)15-29(36)35(17-20-3-4-20)18-23-16-22(26-19-34-9-1-2-28(34)32-26)6-8-27(23)33-10-12-37-13-11-33;1-21(35)32-10-2-4-24(18-32)29(36)34(17-22-6-7-22)19-25-16-23(26-20-33-11-3-5-28(33)30-26)8-9-27(25)31-12-14-37-15-13-31;1-18-7-8-22(13-26(18)34-4)28(33)29-14-23-12-21(24-17-31-11-5-6-27(31)30-24)9-10-25(23)32-15-19(2)35-20(3)16-32;23-14-17-5-2-7-19(13-17)21(26)10-9-16-4-1-6-18(12-16)20-15-25-11-3-8-22(25)24-20/h8,11-13,15-16,19,21,25H,3-7,9-10,14,17-18H2,1-2H3;5-8,14,16,19-20H,1-4,9-13,15,17-18H2;8-9,16,20,22,24H,2-7,10-15,17-19H2,1H3;7-10,12-13,17,19-20H,5-6,11,14-16H2,1-4H3,(H,29,33);1-2,4-7,12-13,15H,3,8-11H2.

What are the key properties of 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile?

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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile has a molecular weight of 2346.82 g/mol, XLogP of 23.29, 35 rotatable bonds, 1 hydrogen bond donors, and 26 hydrogen bond acceptors.

Where does this data come from?

All data for 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;N-[[2-cyclobutyloxy-5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]methyl]-N-(cyclopropylmethyl)-3-methoxy-4-methylbenzamide;N-(cyclopropylmethyl)-2-(3,4-dichlorophenyl)-N-[[5-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)-2-morpholin-4-ylphenyl]methyl]acetamide;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;3-[3-[3-(6,7-dihydro-5H-pyrrolo[1,2-a]imidazol-2-yl)phenyl]propanoyl]benzonitrile is sourced from PubChem (CID 160516596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).