(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride

C8H11Cl2N3 — CID 178200821

IUPAC(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride
SMILESCl.NC(c1nccnc1Cl)C1CC1
InChIInChI=1S/C8H10ClN3.ClH/c9-8-7(11-3-4-12-8)6(10)5-1-2-5;/h3-6H,1-2,10H2;1H
InChIKeyJAGUIFHLSVRTPX-UHFFFAOYSA-N
MW220.10 g/mol
LogP1.96
Rot. Bonds2

About (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride

(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride (PubChem CID 178200821) has the molecular formula C8H11Cl2N3 and a molecular weight of 220.10 g/mol. Its IUPAC name is (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride.

Molecular Properties

Compound Name(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride
PubChem CID178200821
Molecular FormulaC8H11Cl2N3
Molecular Weight220.10 g/mol
Exact Mass219.03
IUPAC Name(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride
SMILESCl.NC(c1nccnc1Cl)C1CC1
InChIInChI=1S/C8H10ClN3.ClH/c9-8-7(11-3-4-12-8)6(10)5-1-2-5;/h3-6H,1-2,10H2;1H
InChIKeyJAGUIFHLSVRTPX-UHFFFAOYSA-N
XLogP1.96
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.10
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride 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 (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride?
The IUPAC name of (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride (CID 178200821) is (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride.
What is the SMILES notation for (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride?
The canonical SMILES for (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride is Cl.NC(c1nccnc1Cl)C1CC1.
What is the InChIKey of (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride?
The InChIKey is JAGUIFHLSVRTPX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN3.ClH/c9-8-7(11-3-4-12-8)6(10)5-1-2-5;/h3-6H,1-2,10H2;1H.
What are the key properties of (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride?
(3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride has a molecular weight of 220.10 g/mol, XLogP of 1.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (3-chloropyrazin-2-yl)-cyclopropylmethanamine;hydrochloride is sourced from PubChem (CID 178200821), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).