3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline

C14H13N3 — CID 2771080

IUPAC3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1cccc2nc(-c3cccc(N)c3)cn12
InChIInChI=1S/C14H13N3/c1-10-4-2-7-14-16-13(9-17(10)14)11-5-3-6-12(15)8-11/h2-9H,15H2,1H3
InChIKeyGFKCECHTFBAIRY-UHFFFAOYSA-N
MW223.28 g/mol
LogP2.89
Rot. Bonds1

About 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline

3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline (PubChem CID 2771080) has the molecular formula C14H13N3 and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline.

Molecular Properties

Compound Name3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline
PubChem CID2771080
Molecular FormulaC14H13N3
Molecular Weight223.28 g/mol
Exact Mass223.11
IUPAC Name3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline
SMILESCc1cccc2nc(-c3cccc(N)c3)cn12
InChIInChI=1S/C14H13N3/c1-10-4-2-7-14-16-13(9-17(10)14)11-5-3-6-12(15)8-11/h2-9H,15H2,1H3
InChIKeyGFKCECHTFBAIRY-UHFFFAOYSA-N
XLogP2.89
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The IUPAC name of 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline (CID 2771080) is 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline.
What is the SMILES notation for 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The canonical SMILES for 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline is Cc1cccc2nc(-c3cccc(N)c3)cn12.
What is the InChIKey of 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline?
The InChIKey is GFKCECHTFBAIRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H13N3/c1-10-4-2-7-14-16-13(9-17(10)14)11-5-3-6-12(15)8-11/h2-9H,15H2,1H3.
What are the key properties of 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline?
3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline has a molecular weight of 223.28 g/mol, XLogP of 2.89, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methylimidazo[1,2-a]pyridin-2-yl)aniline is sourced from PubChem (CID 2771080), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).