2-chloro-6-methylcyclohex-2-en-1-amine

C7H12ClN — CID 143703375

IUPAC2-chloro-6-methylcyclohex-2-en-1-amine
SMILESCC1CCC=C(Cl)C1N
InChIInChI=1S/C7H12ClN/c1-5-3-2-4-6(8)7(5)9/h4-5,7H,2-3,9H2,1H3
InChIKeyGJWXZLQDJFVSFM-UHFFFAOYSA-N
MW145.63 g/mol
LogP1.87
Rot. Bonds

About 2-chloro-6-methylcyclohex-2-en-1-amine

2-chloro-6-methylcyclohex-2-en-1-amine (PubChem CID 143703375) has the molecular formula C7H12ClN and a molecular weight of 145.63 g/mol. Its IUPAC name is 2-chloro-6-methylcyclohex-2-en-1-amine.

Molecular Properties

Compound Name2-chloro-6-methylcyclohex-2-en-1-amine
PubChem CID143703375
Molecular FormulaC7H12ClN
Molecular Weight145.63 g/mol
Exact Mass145.07
IUPAC Name2-chloro-6-methylcyclohex-2-en-1-amine
SMILESCC1CCC=C(Cl)C1N
InChIInChI=1S/C7H12ClN/c1-5-3-2-4-6(8)7(5)9/h4-5,7H,2-3,9H2,1H3
InChIKeyGJWXZLQDJFVSFM-UHFFFAOYSA-N
XLogP1.87
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500145.63
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 2-chloro-6-methylcyclohex-2-en-1-amine with MolForge

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

Launch Full Analysis

Related Compounds

(1S,6S)-2-chloro-6-methylcyclohex-2-en-1-ol
CID 58637363
(1R)-2-chlorocyclopent-2-en-1-amine;hydrochloride
CID 118540639
2-cyclobutyl-6-methylcyclohex-2-en-1-amine
CID 66604382
1-chloro-6-methylcyclohexene
CID 565192
6-chloro-1-fluoro-5-methylcyclohexene
CID 90876325
(1S,2S)-3-chlorocyclohex-3-ene-1,2-diol
CID 67478154
3-chlorocyclohex-3-ene-1,2-diol
CID 67478203
5-methylbicyclo[4.1.0]hept-1-ene
CID 123971358
1-chloro-5,6-diethylcyclohexene
CID 148572658
2-chloro-5-methyl-4,5,6,7-tetrahydro-1-benzothiophen-4-amine
CID 82277947
ethyl 6-carbamoyl-5-methylcyclohexene-1-carboxylate
CID 57225543
1-chloro-5-methyl-4,5,6,7-tetrahydro-2H-isoindol-4-amine
CID 112714820

Frequently Asked Questions

What is the IUPAC name of 2-chloro-6-methylcyclohex-2-en-1-amine?
The IUPAC name of 2-chloro-6-methylcyclohex-2-en-1-amine (CID 143703375) is 2-chloro-6-methylcyclohex-2-en-1-amine.
What is the SMILES notation for 2-chloro-6-methylcyclohex-2-en-1-amine?
The canonical SMILES for 2-chloro-6-methylcyclohex-2-en-1-amine is CC1CCC=C(Cl)C1N.
What is the InChIKey of 2-chloro-6-methylcyclohex-2-en-1-amine?
The InChIKey is GJWXZLQDJFVSFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H12ClN/c1-5-3-2-4-6(8)7(5)9/h4-5,7H,2-3,9H2,1H3.
What are the key properties of 2-chloro-6-methylcyclohex-2-en-1-amine?
2-chloro-6-methylcyclohex-2-en-1-amine has a molecular weight of 145.63 g/mol, XLogP of 1.87, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-6-methylcyclohex-2-en-1-amine is sourced from PubChem (CID 143703375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).