1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide

C22H17Cl2N3O — CID 70943881

IUPAC1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(NC(=O)c1nc(-c2cccc(Cl)c2)c2ccccn12)c1ccccc1Cl
InChIInChI=1S/C22H17Cl2N3O/c1-14(17-9-2-3-10-18(17)24)25-22(28)21-26-20(15-7-6-8-16(23)13-15)19-11-4-5-12-27(19)21/h2-14H,1H3,(H,25,28)
InChIKeyBOWPCNIZQIGWPK-UHFFFAOYSA-N
MW410.30 g/mol
LogP5.80
Rot. Bonds4

About 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide

1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide (PubChem CID 70943881) has the molecular formula C22H17Cl2N3O and a molecular weight of 410.30 g/mol. Its IUPAC name is 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide
PubChem CID70943881
Molecular FormulaC22H17Cl2N3O
Molecular Weight410.30 g/mol
Exact Mass409.07
IUPAC Name1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide
SMILESCC(NC(=O)c1nc(-c2cccc(Cl)c2)c2ccccn12)c1ccccc1Cl
InChIInChI=1S/C22H17Cl2N3O/c1-14(17-9-2-3-10-18(17)24)25-22(28)21-26-20(15-7-6-8-16(23)13-15)19-11-4-5-12-27(19)21/h2-14H,1H3,(H,25,28)
InChIKeyBOWPCNIZQIGWPK-UHFFFAOYSA-N
XLogP5.80
TPSA46.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500410.30
LogP ≤ 55.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide?
The IUPAC name of 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide (CID 70943881) is 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide.
What is the SMILES notation for 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide?
The canonical SMILES for 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide is CC(NC(=O)c1nc(-c2cccc(Cl)c2)c2ccccn12)c1ccccc1Cl.
What is the InChIKey of 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide?
The InChIKey is BOWPCNIZQIGWPK-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17Cl2N3O/c1-14(17-9-2-3-10-18(17)24)25-22(28)21-26-20(15-7-6-8-16(23)13-15)19-11-4-5-12-27(19)21/h2-14H,1H3,(H,25,28).
What are the key properties of 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide?
1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide has a molecular weight of 410.30 g/mol, XLogP of 5.80, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-chlorophenyl)-N-[1-(2-chlorophenyl)ethyl]imidazo[1,5-a]pyridine-3-carboxamide is sourced from PubChem (CID 70943881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).