1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine

C14H19Cl2N — CID 53317145

IUPAC1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine
SMILESCN(C)CC1(c2ccc(Cl)c(Cl)c2)CCCC1
InChIInChI=1S/C14H19Cl2N/c1-17(2)10-14(7-3-4-8-14)11-5-6-12(15)13(16)9-11/h5-6,9H,3-4,7-8,10H2,1-2H3
InChIKeyCLQNHTVQVGGNMJ-UHFFFAOYSA-N
MW272.22 g/mol
LogP4.37
Rot. Bonds3

About 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine

1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine (PubChem CID 53317145) has the molecular formula C14H19Cl2N and a molecular weight of 272.22 g/mol. Its IUPAC name is 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine.

Molecular Properties

Compound Name1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine
PubChem CID53317145
Molecular FormulaC14H19Cl2N
Molecular Weight272.22 g/mol
Exact Mass271.09
IUPAC Name1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine
SMILESCN(C)CC1(c2ccc(Cl)c(Cl)c2)CCCC1
InChIInChI=1S/C14H19Cl2N/c1-17(2)10-14(7-3-4-8-14)11-5-6-12(15)13(16)9-11/h5-6,9H,3-4,7-8,10H2,1-2H3
InChIKeyCLQNHTVQVGGNMJ-UHFFFAOYSA-N
XLogP4.37
TPSA3.24 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.22
LogP ≤ 54.37
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Analyze 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine 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 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine?
The IUPAC name of 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine (CID 53317145) is 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine.
What is the SMILES notation for 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine?
The canonical SMILES for 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine is CN(C)CC1(c2ccc(Cl)c(Cl)c2)CCCC1.
What is the InChIKey of 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine?
The InChIKey is CLQNHTVQVGGNMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19Cl2N/c1-17(2)10-14(7-3-4-8-14)11-5-6-12(15)13(16)9-11/h5-6,9H,3-4,7-8,10H2,1-2H3.
What are the key properties of 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine?
1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine has a molecular weight of 272.22 g/mol, XLogP of 4.37, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(3,4-dichlorophenyl)cyclopentyl]-N,N-dimethylmethanamine is sourced from PubChem (CID 53317145), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).