(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone

C15H11ClN2O2 — CID 7150868

IUPAC(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone
SMILESCOc1ccc(C(=O)c2cnc3ccccn23)cc1Cl
InChIInChI=1S/C15H11ClN2O2/c1-20-13-6-5-10(8-11(13)16)15(19)12-9-17-14-4-2-3-7-18(12)14/h2-9H,1H3
InChIKeyWKYINSQJNAOVLC-UHFFFAOYSA-N
MW286.72 g/mol
LogP3.23
Rot. Bonds3

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

(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone (PubChem CID 7150868) has the molecular formula C15H11ClN2O2 and a molecular weight of 286.72 g/mol. Its IUPAC name is (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone.

Molecular Properties

Compound Name(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone
PubChem CID7150868
Molecular FormulaC15H11ClN2O2
Molecular Weight286.72 g/mol
Exact Mass286.05
IUPAC Name(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone
SMILESCOc1ccc(C(=O)c2cnc3ccccn23)cc1Cl
InChIInChI=1S/C15H11ClN2O2/c1-20-13-6-5-10(8-11(13)16)15(19)12-9-17-14-4-2-3-7-18(12)14/h2-9H,1H3
InChIKeyWKYINSQJNAOVLC-UHFFFAOYSA-N
XLogP3.23
TPSA43.60 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500286.72
LogP ≤ 53.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone?
The IUPAC name of (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone (CID 7150868) is (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone.
What is the SMILES notation for (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone?
The canonical SMILES for (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone is COc1ccc(C(=O)c2cnc3ccccn23)cc1Cl.
What is the InChIKey of (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone?
The InChIKey is WKYINSQJNAOVLC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClN2O2/c1-20-13-6-5-10(8-11(13)16)15(19)12-9-17-14-4-2-3-7-18(12)14/h2-9H,1H3.
What are the key properties of (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone?
(3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone has a molecular weight of 286.72 g/mol, XLogP of 3.23, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloro-4-methoxyphenyl)-imidazo[1,2-a]pyridin-3-ylmethanone is sourced from PubChem (CID 7150868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).