(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine

C12H14ClN3 — CID 83869199

IUPAC(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine
SMILESNCc1cccn2c(C3CCC3)nc(Cl)c12
InChIInChI=1S/C12H14ClN3/c13-11-10-9(7-14)5-2-6-16(10)12(15-11)8-3-1-4-8/h2,5-6,8H,1,3-4,7,14H2
InChIKeyRFWBRWACXBLRSW-UHFFFAOYSA-N
MW235.72 g/mol
LogP2.71
Rot. Bonds2

About (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine

(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine (PubChem CID 83869199) has the molecular formula C12H14ClN3 and a molecular weight of 235.72 g/mol. Its IUPAC name is (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine.

Molecular Properties

Compound Name(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine
PubChem CID83869199
Molecular FormulaC12H14ClN3
Molecular Weight235.72 g/mol
Exact Mass235.09
IUPAC Name(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine
SMILESNCc1cccn2c(C3CCC3)nc(Cl)c12
InChIInChI=1S/C12H14ClN3/c13-11-10-9(7-14)5-2-6-16(10)12(15-11)8-3-1-4-8/h2,5-6,8H,1,3-4,7,14H2
InChIKeyRFWBRWACXBLRSW-UHFFFAOYSA-N
XLogP2.71
TPSA43.32 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.72
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine?
The IUPAC name of (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine (CID 83869199) is (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine.
What is the SMILES notation for (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine?
The canonical SMILES for (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine is NCc1cccn2c(C3CCC3)nc(Cl)c12.
What is the InChIKey of (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine?
The InChIKey is RFWBRWACXBLRSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14ClN3/c13-11-10-9(7-14)5-2-6-16(10)12(15-11)8-3-1-4-8/h2,5-6,8H,1,3-4,7,14H2.
What are the key properties of (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine?
(1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine has a molecular weight of 235.72 g/mol, XLogP of 2.71, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-chloro-3-cyclobutylimidazo[1,5-a]pyridin-8-yl)methanamine is sourced from PubChem (CID 83869199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).