6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine

C19H26ClN3 — CID 808991

IUPAC6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine
SMILESClc1ccc2nc(C3CCCCC3)c(NC3CCCCC3)n2c1
InChIInChI=1S/C19H26ClN3/c20-15-11-12-17-22-18(14-7-3-1-4-8-14)19(23(17)13-15)21-16-9-5-2-6-10-16/h11-14,16,21H,1-10H2
InChIKeyJEHFCKBQNVCWGT-UHFFFAOYSA-N
MW331.89 g/mol
LogP5.78
Rot. Bonds3

About 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine

6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine (PubChem CID 808991) has the molecular formula C19H26ClN3 and a molecular weight of 331.89 g/mol. Its IUPAC name is 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine
PubChem CID808991
Molecular FormulaC19H26ClN3
Molecular Weight331.89 g/mol
Exact Mass331.18
IUPAC Name6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine
SMILESClc1ccc2nc(C3CCCCC3)c(NC3CCCCC3)n2c1
InChIInChI=1S/C19H26ClN3/c20-15-11-12-17-22-18(14-7-3-1-4-8-14)19(23(17)13-15)21-16-9-5-2-6-10-16/h11-14,16,21H,1-10H2
InChIKeyJEHFCKBQNVCWGT-UHFFFAOYSA-N
XLogP5.78
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500331.89
LogP ≤ 55.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine (CID 808991) is 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine is Clc1ccc2nc(C3CCCCC3)c(NC3CCCCC3)n2c1.
What is the InChIKey of 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is JEHFCKBQNVCWGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H26ClN3/c20-15-11-12-17-22-18(14-7-3-1-4-8-14)19(23(17)13-15)21-16-9-5-2-6-10-16/h11-14,16,21H,1-10H2.
What are the key properties of 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine?
6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 331.89 g/mol, XLogP of 5.78, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N,2-dicyclohexylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 808991), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).