6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine

C18H17BrClN3 — CID 1154272

IUPAC6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine
SMILESClc1ccc(-c2nc3ccc(Br)cn3c2NC2CCCC2)cc1
InChIInChI=1S/C18H17BrClN3/c19-13-7-10-16-22-17(12-5-8-14(20)9-6-12)18(23(16)11-13)21-15-3-1-2-4-15/h5-11,15,21H,1-4H2
InChIKeyZLTFRSQQNMOCSP-UHFFFAOYSA-N
MW390.71 g/mol
LogP5.77
Rot. Bonds3

About 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine

6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine (PubChem CID 1154272) has the molecular formula C18H17BrClN3 and a molecular weight of 390.71 g/mol. Its IUPAC name is 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine.

Molecular Properties

Compound Name6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine
PubChem CID1154272
Molecular FormulaC18H17BrClN3
Molecular Weight390.71 g/mol
Exact Mass389.03
IUPAC Name6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine
SMILESClc1ccc(-c2nc3ccc(Br)cn3c2NC2CCCC2)cc1
InChIInChI=1S/C18H17BrClN3/c19-13-7-10-16-22-17(12-5-8-14(20)9-6-12)18(23(16)11-13)21-15-3-1-2-4-15/h5-11,15,21H,1-4H2
InChIKeyZLTFRSQQNMOCSP-UHFFFAOYSA-N
XLogP5.77
TPSA29.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500390.71
LogP ≤ 55.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine?
The IUPAC name of 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine (CID 1154272) is 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine.
What is the SMILES notation for 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine?
The canonical SMILES for 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine is Clc1ccc(-c2nc3ccc(Br)cn3c2NC2CCCC2)cc1.
What is the InChIKey of 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine?
The InChIKey is ZLTFRSQQNMOCSP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17BrClN3/c19-13-7-10-16-22-17(12-5-8-14(20)9-6-12)18(23(16)11-13)21-15-3-1-2-4-15/h5-11,15,21H,1-4H2.
What are the key properties of 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine?
6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine has a molecular weight of 390.71 g/mol, XLogP of 5.77, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-bromo-2-(4-chlorophenyl)-N-cyclopentylimidazo[1,2-a]pyridin-3-amine is sourced from PubChem (CID 1154272), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).