[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine

C15H14ClN3 — CID 82342842

IUPAC[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCc1ccc(-c2nc3cccc(Cl)n3c2CN)cc1
InChIInChI=1S/C15H14ClN3/c1-10-5-7-11(8-6-10)15-12(9-17)19-13(16)3-2-4-14(19)18-15/h2-8H,9,17H2,1H3
InChIKeySXQJRQVHKBMCQW-UHFFFAOYSA-N
MW271.75 g/mol
LogP3.42
Rot. Bonds2

About [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine

[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine (PubChem CID 82342842) has the molecular formula C15H14ClN3 and a molecular weight of 271.75 g/mol. Its IUPAC name is [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine.

Molecular Properties

Compound Name[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
PubChem CID82342842
Molecular FormulaC15H14ClN3
Molecular Weight271.75 g/mol
Exact Mass271.09
IUPAC Name[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
SMILESCc1ccc(-c2nc3cccc(Cl)n3c2CN)cc1
InChIInChI=1S/C15H14ClN3/c1-10-5-7-11(8-6-10)15-12(9-17)19-13(16)3-2-4-14(19)18-15/h2-8H,9,17H2,1H3
InChIKeySXQJRQVHKBMCQW-UHFFFAOYSA-N
XLogP3.42
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.75
LogP ≤ 53.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

[5-chloro-2-(4-ethylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 82342843
[2-(3,4-dichlorophenyl)-5-methylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199318
[2-(4-ethoxyphenyl)-5-methylimidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199340
[5-methyl-2-(4-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199222
3-(chloromethyl)-5-methyl-2-(4-propan-2-ylphenyl)imidazo[1,2-a]pyridine
CID 39126201
[2-(4-chlorophenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 2757796
3-(chloromethyl)-2-(4-methylphenyl)imidazo[1,2-a]pyridine
CID 39126150
[4-(5-chloro-[1,2,4]triazolo[4,3-a]pyridin-3-yl)phenyl]methanamine
CID 82343032
[5-methyl-2-(3-nitrophenyl)imidazo[1,2-a]pyridin-3-yl]methanamine
CID 39199238
2-(4-chlorophenyl)-5-methyl-N-(4-methylphenyl)imidazo[1,2-a]pyridin-3-amine
CID 7338705
ethane;3-(4-methylphenyl)-6-phosphanyl-2,6,12-triazatricyclo[6.3.1.04,12]dodeca-1,3,8,10-tetraen-7-one
CID 123693279
[2-(4-methylphenyl)-5,6,7,8-tetrahydroimidazo[2,1-b][1,3]benzothiazol-1-yl]methanamine
CID 39197108

Frequently Asked Questions

What is the IUPAC name of [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The IUPAC name of [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine (CID 82342842) is [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine.
What is the SMILES notation for [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The canonical SMILES for [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine is Cc1ccc(-c2nc3cccc(Cl)n3c2CN)cc1.
What is the InChIKey of [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
The InChIKey is SXQJRQVHKBMCQW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14ClN3/c1-10-5-7-11(8-6-10)15-12(9-17)19-13(16)3-2-4-14(19)18-15/h2-8H,9,17H2,1H3.
What are the key properties of [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine?
[5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine has a molecular weight of 271.75 g/mol, XLogP of 3.42, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [5-chloro-2-(4-methylphenyl)imidazo[1,2-a]pyridin-3-yl]methanamine is sourced from PubChem (CID 82342842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).