(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine

C8H8ClN3 — CID 83869470

IUPAC(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine
SMILESNCc1ncn2c(Cl)cccc12
InChIInChI=1S/C8H8ClN3/c9-8-3-1-2-7-6(4-10)11-5-12(7)8/h1-3,5H,4,10H2
InChIKeyAZDBGQNTHMNJBH-UHFFFAOYSA-N
MW181.63 g/mol
LogP1.45
Rot. Bonds1

About (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine

(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine (PubChem CID 83869470) has the molecular formula C8H8ClN3 and a molecular weight of 181.63 g/mol. Its IUPAC name is (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine.

Molecular Properties

Compound Name(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine
PubChem CID83869470
Molecular FormulaC8H8ClN3
Molecular Weight181.63 g/mol
Exact Mass181.04
IUPAC Name(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine
SMILESNCc1ncn2c(Cl)cccc12
InChIInChI=1S/C8H8ClN3/c9-8-3-1-2-7-6(4-10)11-5-12(7)8/h1-3,5H,4,10H2
InChIKeyAZDBGQNTHMNJBH-UHFFFAOYSA-N
XLogP1.45
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.63
LogP ≤ 51.45
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

1-(5-chloroimidazo[1,5-a]pyridin-1-yl)-N-methylmethanamine
CID 83869471
2-(5-methylimidazo[1,5-a]pyridin-1-yl)ethanamine
CID 83827517
5-bromoimidazo[1,5-a]pyridin-1-amine
CID 83867437
[3-[(4-chlorophenoxy)methyl]imidazo[1,5-a]pyridin-1-yl]methanamine
CID 84760117
2-(bromomethyl)-5-chloroimidazo[1,2-a]pyridine;hydrobromide
CID 137347572
(1-nitroimidazo[1,5-a]pyridin-5-yl)methanamine
CID 83877928
[1-[(2-chloro-3-fluorophenyl)methyl]indazol-3-yl]methanamine
CID 115984346
(3-chloro-2-pyridinyl)methanamine;hydrochloride
CID 86346205
5-chloroimidazo[1,2-a]pyridin-2-ol
CID 105433971
4-[(5-chloroimidazo[1,2-a]pyridin-2-yl)methoxy]benzaldehyde
CID 22344627
1-chloroimidazo[1,5-a]pyridine-5-carbaldehyde
CID 83875633
(3-cyclopropylimidazo[1,5-a]pyridin-1-yl)methanamine
CID 28752172

Frequently Asked Questions

What is the IUPAC name of (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine?
The IUPAC name of (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine (CID 83869470) is (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine.
What is the SMILES notation for (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine?
The canonical SMILES for (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine is NCc1ncn2c(Cl)cccc12.
What is the InChIKey of (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine?
The InChIKey is AZDBGQNTHMNJBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8ClN3/c9-8-3-1-2-7-6(4-10)11-5-12(7)8/h1-3,5H,4,10H2.
What are the key properties of (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine?
(5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine has a molecular weight of 181.63 g/mol, XLogP of 1.45, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloroimidazo[1,5-a]pyridin-1-yl)methanamine is sourced from PubChem (CID 83869470), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).