2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide

C24H20ClN5O3 — CID 118051787

IUPAC2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide
SMILESCCC(C(=O)Nc1ccc2nccn2c1)n1cc(OC)c(-c2cc(Cl)ccc2C#N)cc1=O
InChIInChI=1S/C24H20ClN5O3/c1-3-20(24(32)28-17-6-7-22-27-8-9-29(22)13-17)30-14-21(33-2)19(11-23(30)31)18-10-16(25)5-4-15(18)12-26/h4-11,13-14,20H,3H2,1-2H3,(H,28,32)
InChIKeyZADNRCIXROQDFP-UHFFFAOYSA-N
MW461.91 g/mol
LogP4.29
Rot. Bonds6

About 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide

2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide (PubChem CID 118051787) has the molecular formula C24H20ClN5O3 and a molecular weight of 461.91 g/mol. Its IUPAC name is 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide.

Molecular Properties

Compound Name2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide
PubChem CID118051787
Molecular FormulaC24H20ClN5O3
Molecular Weight461.91 g/mol
Exact Mass461.13
IUPAC Name2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide
SMILESCCC(C(=O)Nc1ccc2nccn2c1)n1cc(OC)c(-c2cc(Cl)ccc2C#N)cc1=O
InChIInChI=1S/C24H20ClN5O3/c1-3-20(24(32)28-17-6-7-22-27-8-9-29(22)13-17)30-14-21(33-2)19(11-23(30)31)18-10-16(25)5-4-15(18)12-26/h4-11,13-14,20H,3H2,1-2H3,(H,28,32)
InChIKeyZADNRCIXROQDFP-UHFFFAOYSA-N
XLogP4.29
TPSA101.42 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms33
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.91
LogP ≤ 54.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

Analyze 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide?
The IUPAC name of 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide (CID 118051787) is 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide.
What is the SMILES notation for 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide?
The canonical SMILES for 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide is CCC(C(=O)Nc1ccc2nccn2c1)n1cc(OC)c(-c2cc(Cl)ccc2C#N)cc1=O.
What is the InChIKey of 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide?
The InChIKey is ZADNRCIXROQDFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H20ClN5O3/c1-3-20(24(32)28-17-6-7-22-27-8-9-29(22)13-17)30-14-21(33-2)19(11-23(30)31)18-10-16(25)5-4-15(18)12-26/h4-11,13-14,20H,3H2,1-2H3,(H,28,32).
What are the key properties of 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide?
2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide has a molecular weight of 461.91 g/mol, XLogP of 4.29, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(5-chloro-2-cyanophenyl)-5-methoxy-2-oxo-1-pyridinyl]-N-imidazo[1,2-a]pyridin-6-ylbutanamide is sourced from PubChem (CID 118051787), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).