2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide

C17H16ClN3O2 — CID 42693936

IUPAC2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
SMILESCOc1ccc(-c2nc3ccccn3c2NC(=O)C(C)Cl)cc1
InChIInChI=1S/C17H16ClN3O2/c1-11(18)17(22)20-16-15(12-6-8-13(23-2)9-7-12)19-14-5-3-4-10-21(14)16/h3-11H,1-2H3,(H,20,22)
InChIKeyATBFKZLPSIQHTA-UHFFFAOYSA-N
MW329.79 g/mol
LogP3.58
Rot. Bonds4

About 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide

2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide (PubChem CID 42693936) has the molecular formula C17H16ClN3O2 and a molecular weight of 329.79 g/mol. Its IUPAC name is 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide.

Molecular Properties

Compound Name2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
PubChem CID42693936
Molecular FormulaC17H16ClN3O2
Molecular Weight329.79 g/mol
Exact Mass329.09
IUPAC Name2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
SMILESCOc1ccc(-c2nc3ccccn3c2NC(=O)C(C)Cl)cc1
InChIInChI=1S/C17H16ClN3O2/c1-11(18)17(22)20-16-15(12-6-8-13(23-2)9-7-12)19-14-5-3-4-10-21(14)16/h3-11H,1-2H3,(H,20,22)
InChIKeyATBFKZLPSIQHTA-UHFFFAOYSA-N
XLogP3.58
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.79
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

(2R)-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylbutanamide
CID 93016839
3,5-dichloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42693942
N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]-2-phenylsulfanylacetamide
CID 42693934
N,2-bis(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-amine
CID 58564445
1-(2,5-dimethoxyphenyl)-3-(2-phenylimidazo[1,2-a]pyridin-3-yl)urea
CID 50847606
(2S)-2-chloro-N-[7-methyl-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide
CID 93016859
4-butyl-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]benzamide
CID 42693948
2-methoxy-N-[2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]acetamide
CID 42694050
(2R)-2-chloro-N-[2-(3,4-dimethoxyphenyl)-7-methylimidazo[1,2-a]pyridin-3-yl]propanamide
CID 93016814
2-(4-methoxyphenyl)-N-(2-methylbutan-2-yl)imidazo[1,2-a]pyridin-3-amine
CID 858000
4-[3-[(4-methoxyphenyl)methylamino]imidazo[1,2-a]pyridin-2-yl]phenol
CID 858017
N-[2-(4-fluorophenyl)imidazo[1,2-a]pyridin-3-yl]-2-methoxyacetamide
CID 42694150

Frequently Asked Questions

What is the IUPAC name of 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide?
The IUPAC name of 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide (CID 42693936) is 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide.
What is the SMILES notation for 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide?
The canonical SMILES for 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide is COc1ccc(-c2nc3ccccn3c2NC(=O)C(C)Cl)cc1.
What is the InChIKey of 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide?
The InChIKey is ATBFKZLPSIQHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16ClN3O2/c1-11(18)17(22)20-16-15(12-6-8-13(23-2)9-7-12)19-14-5-3-4-10-21(14)16/h3-11H,1-2H3,(H,20,22).
What are the key properties of 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide?
2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide has a molecular weight of 329.79 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-N-[2-(4-methoxyphenyl)imidazo[1,2-a]pyridin-3-yl]propanamide is sourced from PubChem (CID 42693936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).