1-benzyl-2,2-dimethylcyclopentan-1-amine

C14H21N — CID 79857228

IUPAC1-benzyl-2,2-dimethylcyclopentan-1-amine
SMILESCC1(C)CCCC1(N)Cc1ccccc1
InChIInChI=1S/C14H21N/c1-13(2)9-6-10-14(13,15)11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11,15H2,1-2H3
InChIKeyDOEICWWAGKIMAK-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.14
Rot. Bonds2

About 1-benzyl-2,2-dimethylcyclopentan-1-amine

1-benzyl-2,2-dimethylcyclopentan-1-amine (PubChem CID 79857228) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is 1-benzyl-2,2-dimethylcyclopentan-1-amine.

Molecular Properties

Compound Name1-benzyl-2,2-dimethylcyclopentan-1-amine
PubChem CID79857228
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name1-benzyl-2,2-dimethylcyclopentan-1-amine
SMILESCC1(C)CCCC1(N)Cc1ccccc1
InChIInChI=1S/C14H21N/c1-13(2)9-6-10-14(13,15)11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11,15H2,1-2H3
InChIKeyDOEICWWAGKIMAK-UHFFFAOYSA-N
XLogP3.14
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze 1-benzyl-2,2-dimethylcyclopentan-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 1-benzyl-2,2-dimethylcyclopentan-1-amine?
The IUPAC name of 1-benzyl-2,2-dimethylcyclopentan-1-amine (CID 79857228) is 1-benzyl-2,2-dimethylcyclopentan-1-amine.
What is the SMILES notation for 1-benzyl-2,2-dimethylcyclopentan-1-amine?
The canonical SMILES for 1-benzyl-2,2-dimethylcyclopentan-1-amine is CC1(C)CCCC1(N)Cc1ccccc1.
What is the InChIKey of 1-benzyl-2,2-dimethylcyclopentan-1-amine?
The InChIKey is DOEICWWAGKIMAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-13(2)9-6-10-14(13,15)11-12-7-4-3-5-8-12/h3-5,7-8H,6,9-11,15H2,1-2H3.
What are the key properties of 1-benzyl-2,2-dimethylcyclopentan-1-amine?
1-benzyl-2,2-dimethylcyclopentan-1-amine has a molecular weight of 203.33 g/mol, XLogP of 3.14, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-benzyl-2,2-dimethylcyclopentan-1-amine is sourced from PubChem (CID 79857228), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).