2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine

C14H12ClN3 — CID 106818523

IUPAC2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3ccccn3c2N)cc1Cl
InChIInChI=1S/C14H12ClN3/c1-9-5-6-10(8-11(9)15)13-14(16)18-7-3-2-4-12(18)17-13/h2-8H,16H2,1H3
InChIKeyXITRTTAETICQAF-UHFFFAOYSA-N
MW257.72 g/mol
LogP3.55
Rot. Bonds1

About 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine

2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine (PubChem CID 106818523) has the molecular formula C14H12ClN3 and a molecular weight of 257.72 g/mol. Its IUPAC name is 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
PubChem CID106818523
Molecular FormulaC14H12ClN3
Molecular Weight257.72 g/mol
Exact Mass257.07
IUPAC Name2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
SMILESCc1ccc(-c2nc3ccccn3c2N)cc1Cl
InChIInChI=1S/C14H12ClN3/c1-9-5-6-10(8-11(9)15)13-14(16)18-7-3-2-4-12(18)17-13/h2-8H,16H2,1H3
InChIKeyXITRTTAETICQAF-UHFFFAOYSA-N
XLogP3.55
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.72
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine (CID 106818523) is 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine is Cc1ccc(-c2nc3ccccn3c2N)cc1Cl.
What is the InChIKey of 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
The InChIKey is XITRTTAETICQAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H12ClN3/c1-9-5-6-10(8-11(9)15)13-14(16)18-7-3-2-4-12(18)17-13/h2-8H,16H2,1H3.
What are the key properties of 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine?
2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine has a molecular weight of 257.72 g/mol, XLogP of 3.55, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-chloro-4-methylphenyl)imidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 106818523), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).