2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide

C20H22ClN3O2 — CID 69061516

IUPAC2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(CC)c1ccc2nc(-c3ccc(OC)cc3Cl)c(C(N)=O)n2c1
InChIInChI=1S/C20H22ClN3O2/c1-4-12(5-2)13-6-9-17-23-18(19(20(22)25)24(17)11-13)15-8-7-14(26-3)10-16(15)21/h6-12H,4-5H2,1-3H3,(H2,22,25)
InChIKeyMWTXFSHFBWOTJE-UHFFFAOYSA-N
MW371.87 g/mol
LogP4.67
Rot. Bonds6

About 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide

2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide (PubChem CID 69061516) has the molecular formula C20H22ClN3O2 and a molecular weight of 371.87 g/mol. Its IUPAC name is 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide
PubChem CID69061516
Molecular FormulaC20H22ClN3O2
Molecular Weight371.87 g/mol
Exact Mass371.14
IUPAC Name2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide
SMILESCCC(CC)c1ccc2nc(-c3ccc(OC)cc3Cl)c(C(N)=O)n2c1
InChIInChI=1S/C20H22ClN3O2/c1-4-12(5-2)13-6-9-17-23-18(19(20(22)25)24(17)11-13)15-8-7-14(26-3)10-16(15)21/h6-12H,4-5H2,1-3H3,(H2,22,25)
InChIKeyMWTXFSHFBWOTJE-UHFFFAOYSA-N
XLogP4.67
TPSA69.62 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.87
LogP ≤ 54.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide?
The IUPAC name of 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide (CID 69061516) is 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide.
What is the SMILES notation for 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide?
The canonical SMILES for 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide is CCC(CC)c1ccc2nc(-c3ccc(OC)cc3Cl)c(C(N)=O)n2c1.
What is the InChIKey of 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide?
The InChIKey is MWTXFSHFBWOTJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22ClN3O2/c1-4-12(5-2)13-6-9-17-23-18(19(20(22)25)24(17)11-13)15-8-7-14(26-3)10-16(15)21/h6-12H,4-5H2,1-3H3,(H2,22,25).
What are the key properties of 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide?
2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide has a molecular weight of 371.87 g/mol, XLogP of 4.67, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-4-methoxyphenyl)-6-pentan-3-ylimidazo[1,2-a]pyridine-3-carboxamide is sourced from PubChem (CID 69061516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).