4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline

C15H22N2 — CID 43276221

IUPAC4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline
SMILESNCc1ccc(N(C2CCCC2)C2CC2)cc1
InChIInChI=1S/C15H22N2/c16-11-12-5-7-14(8-6-12)17(15-9-10-15)13-3-1-2-4-13/h5-8,13,15H,1-4,9-11,16H2
InChIKeyBLBYLYCJEXIKEZ-UHFFFAOYSA-N
MW230.35 g/mol
LogP3.06
Rot. Bonds4

About 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline

4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline (PubChem CID 43276221) has the molecular formula C15H22N2 and a molecular weight of 230.35 g/mol. Its IUPAC name is 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline.

Molecular Properties

Compound Name4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline
PubChem CID43276221
Molecular FormulaC15H22N2
Molecular Weight230.35 g/mol
Exact Mass230.18
IUPAC Name4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline
SMILESNCc1ccc(N(C2CCCC2)C2CC2)cc1
InChIInChI=1S/C15H22N2/c16-11-12-5-7-14(8-6-12)17(15-9-10-15)13-3-1-2-4-13/h5-8,13,15H,1-4,9-11,16H2
InChIKeyBLBYLYCJEXIKEZ-UHFFFAOYSA-N
XLogP3.06
TPSA29.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.35
LogP ≤ 53.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline 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 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline?
The IUPAC name of 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline (CID 43276221) is 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline.
What is the SMILES notation for 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline?
The canonical SMILES for 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline is NCc1ccc(N(C2CCCC2)C2CC2)cc1.
What is the InChIKey of 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline?
The InChIKey is BLBYLYCJEXIKEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2/c16-11-12-5-7-14(8-6-12)17(15-9-10-15)13-3-1-2-4-13/h5-8,13,15H,1-4,9-11,16H2.
What are the key properties of 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline?
4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline has a molecular weight of 230.35 g/mol, XLogP of 3.06, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(aminomethyl)-N-cyclopentyl-N-cyclopropylaniline is sourced from PubChem (CID 43276221), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).