6-chloro-N-cyclopentylpyrazin-2-amine

C9H12ClN3 — CID 10104176

IUPAC6-chloro-N-cyclopentylpyrazin-2-amine
SMILESClc1cncc(NC2CCCC2)n1
InChIInChI=1S/C9H12ClN3/c10-8-5-11-6-9(13-8)12-7-3-1-2-4-7/h5-7H,1-4H2,(H,12,13)
InChIKeyLBQDAQLQAZKFRN-UHFFFAOYSA-N
MW197.67 g/mol
LogP2.48
Rot. Bonds2

About 6-chloro-N-cyclopentylpyrazin-2-amine

6-chloro-N-cyclopentylpyrazin-2-amine (PubChem CID 10104176) has the molecular formula C9H12ClN3 and a molecular weight of 197.67 g/mol. Its IUPAC name is 6-chloro-N-cyclopentylpyrazin-2-amine.

Molecular Properties

Compound Name6-chloro-N-cyclopentylpyrazin-2-amine
PubChem CID10104176
Molecular FormulaC9H12ClN3
Molecular Weight197.67 g/mol
Exact Mass197.07
IUPAC Name6-chloro-N-cyclopentylpyrazin-2-amine
SMILESClc1cncc(NC2CCCC2)n1
InChIInChI=1S/C9H12ClN3/c10-8-5-11-6-9(13-8)12-7-3-1-2-4-7/h5-7H,1-4H2,(H,12,13)
InChIKeyLBQDAQLQAZKFRN-UHFFFAOYSA-N
XLogP2.48
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.67
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze 6-chloro-N-cyclopentylpyrazin-2-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-chloro-N-cyclopentylpyrazin-2-amine?
The IUPAC name of 6-chloro-N-cyclopentylpyrazin-2-amine (CID 10104176) is 6-chloro-N-cyclopentylpyrazin-2-amine.
What is the SMILES notation for 6-chloro-N-cyclopentylpyrazin-2-amine?
The canonical SMILES for 6-chloro-N-cyclopentylpyrazin-2-amine is Clc1cncc(NC2CCCC2)n1.
What is the InChIKey of 6-chloro-N-cyclopentylpyrazin-2-amine?
The InChIKey is LBQDAQLQAZKFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12ClN3/c10-8-5-11-6-9(13-8)12-7-3-1-2-4-7/h5-7H,1-4H2,(H,12,13).
What are the key properties of 6-chloro-N-cyclopentylpyrazin-2-amine?
6-chloro-N-cyclopentylpyrazin-2-amine has a molecular weight of 197.67 g/mol, XLogP of 2.48, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-N-cyclopentylpyrazin-2-amine is sourced from PubChem (CID 10104176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).