N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine

C11H14ClN — CID 62397679

IUPACN-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine
SMILESCC1CC1NCc1ccccc1Cl
InChIInChI=1S/C11H14ClN/c1-8-6-11(8)13-7-9-4-2-3-5-10(9)12/h2-5,8,11,13H,6-7H2,1H3
InChIKeyGQWLOUFFTCAHKP-UHFFFAOYSA-N
MW195.69 g/mol
LogP2.84
Rot. Bonds3

About N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine

N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine (PubChem CID 62397679) has the molecular formula C11H14ClN and a molecular weight of 195.69 g/mol. Its IUPAC name is N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine.

Molecular Properties

Compound NameN-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine
PubChem CID62397679
Molecular FormulaC11H14ClN
Molecular Weight195.69 g/mol
Exact Mass195.08
IUPAC NameN-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine
SMILESCC1CC1NCc1ccccc1Cl
InChIInChI=1S/C11H14ClN/c1-8-6-11(8)13-7-9-4-2-3-5-10(9)12/h2-5,8,11,13H,6-7H2,1H3
InChIKeyGQWLOUFFTCAHKP-UHFFFAOYSA-N
XLogP2.84
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.69
LogP ≤ 52.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-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

Frequently Asked Questions

What is the IUPAC name of N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine?
The IUPAC name of N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine (CID 62397679) is N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine.
What is the SMILES notation for N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine?
The canonical SMILES for N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine is CC1CC1NCc1ccccc1Cl.
What is the InChIKey of N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine?
The InChIKey is GQWLOUFFTCAHKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14ClN/c1-8-6-11(8)13-7-9-4-2-3-5-10(9)12/h2-5,8,11,13H,6-7H2,1H3.
What are the key properties of N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine?
N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine has a molecular weight of 195.69 g/mol, XLogP of 2.84, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-chlorophenyl)methyl]-2-methylcyclopropan-1-amine is sourced from PubChem (CID 62397679), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).