3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid

C64H49Cl7N18O2 — CID 157197044

About 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid

3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid (PubChem CID 157197044) has the molecular formula C64H49Cl7N18O2 and a molecular weight of 1350.39 g/mol. Its IUPAC name is 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid.

Molecular Properties

• Compound Name: 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid
• PubChem CID: 157197044
• Molecular Formula: C64H49Cl7N18O2
• Molecular Weight: 1350.39 g/mol
• Exact Mass: 1346.21
• IUPAC Name: 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid
• SMILES: Clc1cnc2ccc(Cc3nc4c(Cl)nccc4[nH]3)cc2c1.Clc1cnc2ccc(Cc3nc4c(NCc5cnc6[nH]cc(Cl)c6c5)nccc4[nH]3)cc2c1.NCc1cnc2[nH]cc(Cl)c2c1.Nc1ccnc(Cl)c1N.O=C(O)Cc1ccc2ncc(Cl)cc2c1
• InChI: InChI=1S/C24H17Cl2N7.C16H10Cl2N4.C11H8ClNO2.C8H8ClN3.C5H6ClN3/c25-16-8-15-5-13(1-2-19(15)28-11-16)7-21-32-20-3-4-27-24(22(20)33-21)30-10-14-6-17-18(26)12-31-23(17)29-9-14;17-11-7-10-5-9(1-2-12(10)20-8-11)6-14-21-13-3-4-19-16(18)15(13)22-14;12-9-5-8-3-7(4-11(14)15)1-2-10(8)13-6-9;9-7-4-12-8-6(7)1-5(2-10)3-11-8;6-5-4(8)3(7)1-2-9-5/h1-6,8-9,11-12H,7,10H2,(H,27,30)(H,29,31)(H,32,33);1-5,7-8H,6H2,(H,21,22);1-3,5-6H,4H2,(H,14,15);1,3-4H,2,10H2,(H,11,12);1-2H,8H2,(H2,7,9)
• InChIKey: AQJFWNPZKNQTRR-UHFFFAOYSA-N
• XLogP: 15.39
• TPSA: 319.45 Ų
• H-Bond Donors: 9
• H-Bond Acceptors: 15
• Rotatable Bonds: 10
• Heavy Atoms: 91
• Complexity: —

Lipinski Rule of Five

4 violations

Rule	Value
MW ≤ 500	1350.39
LogP ≤ 5	15.39
H-Bond Donors ≤ 5	9
H-Bond Acceptors ≤ 10	15

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid?

The IUPAC name of 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid (CID 157197044) is 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid.

What is the SMILES notation for 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid?

The canonical SMILES for 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid is Clc1cnc2ccc(Cc3nc4c(Cl)nccc4[nH]3)cc2c1.Clc1cnc2ccc(Cc3nc4c(NCc5cnc6[nH]cc(Cl)c6c5)nccc4[nH]3)cc2c1.NCc1cnc2[nH]cc(Cl)c2c1.Nc1ccnc(Cl)c1N.O=C(O)Cc1ccc2ncc(Cl)cc2c1.

What is the InChIKey of 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid?

The InChIKey is AQJFWNPZKNQTRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H17Cl2N7.C16H10Cl2N4.C11H8ClNO2.C8H8ClN3.C5H6ClN3/c25-16-8-15-5-13(1-2-19(15)28-11-16)7-21-32-20-3-4-27-24(22(20)33-21)30-10-14-6-17-18(26)12-31-23(17)29-9-14;17-11-7-10-5-9(1-2-12(10)20-8-11)6-14-21-13-3-4-19-16(18)15(13)22-14;12-9-5-8-3-7(4-11(14)15)1-2-10(8)13-6-9;9-7-4-12-8-6(7)1-5(2-10)3-11-8;6-5-4(8)3(7)1-2-9-5/h1-6,8-9,11-12H,7,10H2,(H,27,30)(H,29,31)(H,32,33);1-5,7-8H,6H2,(H,21,22);1-3,5-6H,4H2,(H,14,15);1,3-4H,2,10H2,(H,11,12);1-2H,8H2,(H2,7,9).

What are the key properties of 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid?

3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid has a molecular weight of 1350.39 g/mol, XLogP of 15.39, 10 rotatable bonds, 9 hydrogen bond donors, and 15 hydrogen bond acceptors.

Where does this data come from?

All data for 3-chloro-6-[(4-chloro-1H-imidazo[4,5-c]pyridin-2-yl)methyl]quinoline;2-chloropyridine-3,4-diamine;(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methanamine;N-[(3-chloro-1H-pyrrolo[2,3-b]pyridin-5-yl)methyl]-2-[(3-chloroquinolin-6-yl)methyl]-1H-imidazo[4,5-c]pyridin-4-amine;2-(3-chloroquinolin-6-yl)acetic acid is sourced from PubChem (CID 157197044), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).