(5-chloro-2-methylphenyl)methanamine;hydrochloride

C8H11Cl2N — CID 75525789

IUPAC(5-chloro-2-methylphenyl)methanamine;hydrochloride
SMILESCc1ccc(Cl)cc1CN.Cl
InChIInChI=1S/C8H10ClN.ClH/c1-6-2-3-8(9)4-7(6)5-10;/h2-4H,5,10H2,1H3;1H
InChIKeyISUVLFMHANADML-UHFFFAOYSA-N
MW192.09 g/mol
LogP2.53
Rot. Bonds1

About (5-chloro-2-methylphenyl)methanamine;hydrochloride

(5-chloro-2-methylphenyl)methanamine;hydrochloride (PubChem CID 75525789) has the molecular formula C8H11Cl2N and a molecular weight of 192.09 g/mol. Its IUPAC name is (5-chloro-2-methylphenyl)methanamine;hydrochloride.

Molecular Properties

Compound Name(5-chloro-2-methylphenyl)methanamine;hydrochloride
PubChem CID75525789
Molecular FormulaC8H11Cl2N
Molecular Weight192.09 g/mol
Exact Mass191.03
IUPAC Name(5-chloro-2-methylphenyl)methanamine;hydrochloride
SMILESCc1ccc(Cl)cc1CN.Cl
InChIInChI=1S/C8H10ClN.ClH/c1-6-2-3-8(9)4-7(6)5-10;/h2-4H,5,10H2,1H3;1H
InChIKeyISUVLFMHANADML-UHFFFAOYSA-N
XLogP2.53
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.09
LogP ≤ 52.53
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze (5-chloro-2-methylphenyl)methanamine;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 (5-chloro-2-methylphenyl)methanamine;hydrochloride?
The IUPAC name of (5-chloro-2-methylphenyl)methanamine;hydrochloride (CID 75525789) is (5-chloro-2-methylphenyl)methanamine;hydrochloride.
What is the SMILES notation for (5-chloro-2-methylphenyl)methanamine;hydrochloride?
The canonical SMILES for (5-chloro-2-methylphenyl)methanamine;hydrochloride is Cc1ccc(Cl)cc1CN.Cl.
What is the InChIKey of (5-chloro-2-methylphenyl)methanamine;hydrochloride?
The InChIKey is ISUVLFMHANADML-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10ClN.ClH/c1-6-2-3-8(9)4-7(6)5-10;/h2-4H,5,10H2,1H3;1H.
What are the key properties of (5-chloro-2-methylphenyl)methanamine;hydrochloride?
(5-chloro-2-methylphenyl)methanamine;hydrochloride has a molecular weight of 192.09 g/mol, XLogP of 2.53, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for (5-chloro-2-methylphenyl)methanamine;hydrochloride is sourced from PubChem (CID 75525789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).