2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine

C72H56Cl10N10O5 — CID 160883498

About 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine

2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine (PubChem CID 160883498) has the molecular formula C72H56Cl10N10O5 and a molecular weight of 1495.83 g/mol. Its IUPAC name is 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine.

Molecular Properties

• Compound Name: 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine
• PubChem CID: 160883498
• Molecular Formula: C72H56Cl10N10O5
• Molecular Weight: 1495.83 g/mol
• Exact Mass: 1490.13
• IUPAC Name: 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine
• SMILES: Clc1ccc(Cc2ncc3ccccn23)c(Cl)c1.NCc1ccccn1.O=C(Cc1ccc(Cl)cc1Cl)NCc1ccccn1.O=C(O)Cc1ccc(Cl)cc1Cl.O=Cc1nc(Cc2ccc(Cl)cc2Cl)n2ccccc12.O=Cc1nc(Cc2ccc(Cl)cc2Cl)n2ccccc12
• InChI: InChI=1S/2C15H10Cl2N2O.C14H12Cl2N2O.C14H10Cl2N2.C8H6Cl2O2.C6H8N2/c2*16-11-5-4-10(12(17)8-11)7-15-18-13(9-20)14-3-1-2-6-19(14)15;15-11-5-4-10(13(16)8-11)7-14(19)18-9-12-3-1-2-6-17-12;15-11-5-4-10(13(16)8-11)7-14-17-9-12-3-1-2-6-18(12)14;9-6-2-1-5(3-8(11)12)7(10)4-6;7-5-6-3-1-2-4-8-6/h2*1-6,8-9H,7H2;1-6,8H,7,9H2,(H,18,19);1-6,8-9H,7H2;1-2,4H,3H2,(H,11,12);1-4H,5,7H2
• InChIKey: SNIHXKCNMVFLGR-UHFFFAOYSA-N
• XLogP: 18.73
• TPSA: 204.24 Ų
• H-Bond Donors: 3
• H-Bond Acceptors: 13
• Rotatable Bonds: 15
• Heavy Atoms: 97
• Complexity: —

Lipinski Rule of Five

3 violations

Rule	Value
MW ≤ 500	1495.83
LogP ≤ 5	18.73
H-Bond Donors ≤ 5	3
H-Bond Acceptors ≤ 10	13

Computed Properties (RDKit)

• Structural Alerts: {'alert_name': 'aldehyde', 'substructure': 'N/A'}

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine?

The IUPAC name of 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine (CID 160883498) is 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine.

What is the SMILES notation for 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine?

The canonical SMILES for 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine is Clc1ccc(Cc2ncc3ccccn23)c(Cl)c1.NCc1ccccn1.O=C(Cc1ccc(Cl)cc1Cl)NCc1ccccn1.O=C(O)Cc1ccc(Cl)cc1Cl.O=Cc1nc(Cc2ccc(Cl)cc2Cl)n2ccccc12.O=Cc1nc(Cc2ccc(Cl)cc2Cl)n2ccccc12.

What is the InChIKey of 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine?

The InChIKey is SNIHXKCNMVFLGR-UHFFFAOYSA-N. The full InChI is InChI=1S/2C15H10Cl2N2O.C14H12Cl2N2O.C14H10Cl2N2.C8H6Cl2O2.C6H8N2/c2*16-11-5-4-10(12(17)8-11)7-15-18-13(9-20)14-3-1-2-6-19(14)15;15-11-5-4-10(13(16)8-11)7-14(19)18-9-12-3-1-2-6-17-12;15-11-5-4-10(13(16)8-11)7-14-17-9-12-3-1-2-6-18(12)14;9-6-2-1-5(3-8(11)12)7(10)4-6;7-5-6-3-1-2-4-8-6/h2*1-6,8-9H,7H2;1-6,8H,7,9H2,(H,18,19);1-6,8-9H,7H2;1-2,4H,3H2,(H,11,12);1-4H,5,7H2.

What are the key properties of 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine?

2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine has a molecular weight of 1495.83 g/mol, XLogP of 18.73, 15 rotatable bonds, 3 hydrogen bond donors, and 13 hydrogen bond acceptors.

Where does this data come from?

All data for 2-(2,4-dichlorophenyl)acetic acid;3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine;bis(3-[(2,4-dichlorophenyl)methyl]imidazo[1,5-a]pyridine-1-carbaldehyde);2-(2,4-dichlorophenyl)-N-(pyridin-2-ylmethyl)acetamide;pyridin-2-ylmethanamine is sourced from PubChem (CID 160883498), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).