2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine

C15H21ClN4 — CID 82143881

IUPAC2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
SMILESCC(CN)n1c(C2CCCCC2)nc2cc(Cl)cnc21
InChIInChI=1S/C15H21ClN4/c1-10(8-17)20-14(11-5-3-2-4-6-11)19-13-7-12(16)9-18-15(13)20/h7,9-11H,2-6,8,17H2,1H3
InChIKeyDORIXGNXOVDNTM-UHFFFAOYSA-N
MW292.81 g/mol
LogP3.65
Rot. Bonds3

About 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine

2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine (PubChem CID 82143881) has the molecular formula C15H21ClN4 and a molecular weight of 292.81 g/mol. Its IUPAC name is 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine.

Molecular Properties

Compound Name2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
PubChem CID82143881
Molecular FormulaC15H21ClN4
Molecular Weight292.81 g/mol
Exact Mass292.15
IUPAC Name2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine
SMILESCC(CN)n1c(C2CCCCC2)nc2cc(Cl)cnc21
InChIInChI=1S/C15H21ClN4/c1-10(8-17)20-14(11-5-3-2-4-6-11)19-13-7-12(16)9-18-15(13)20/h7,9-11H,2-6,8,17H2,1H3
InChIKeyDORIXGNXOVDNTM-UHFFFAOYSA-N
XLogP3.65
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 53.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine?
The IUPAC name of 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine (CID 82143881) is 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine.
What is the SMILES notation for 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine?
The canonical SMILES for 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine is CC(CN)n1c(C2CCCCC2)nc2cc(Cl)cnc21.
What is the InChIKey of 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine?
The InChIKey is DORIXGNXOVDNTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21ClN4/c1-10(8-17)20-14(11-5-3-2-4-6-11)19-13-7-12(16)9-18-15(13)20/h7,9-11H,2-6,8,17H2,1H3.
What are the key properties of 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine?
2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine has a molecular weight of 292.81 g/mol, XLogP of 3.65, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-2-cyclohexylimidazo[4,5-b]pyridin-3-yl)propan-1-amine is sourced from PubChem (CID 82143881), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).