N-cyclopropyl-4-phenylaniline

C15H15N — CID 83702708

IUPACN-cyclopropyl-4-phenylaniline
SMILESc1ccc(-c2ccc(NC3CC3)cc2)cc1
InChIInChI=1S/C15H15N/c1-2-4-12(5-3-1)13-6-8-14(9-7-13)16-15-10-11-15/h1-9,15-16H,10-11H2
InChIKeyNIUXNLHKQMSTQS-UHFFFAOYSA-N
MW209.29 g/mol
LogP3.93
Rot. Bonds3

About N-cyclopropyl-4-phenylaniline

N-cyclopropyl-4-phenylaniline (PubChem CID 83702708) has the molecular formula C15H15N and a molecular weight of 209.29 g/mol. Its IUPAC name is N-cyclopropyl-4-phenylaniline.

Molecular Properties

Compound NameN-cyclopropyl-4-phenylaniline
PubChem CID83702708
Molecular FormulaC15H15N
Molecular Weight209.29 g/mol
Exact Mass209.12
IUPAC NameN-cyclopropyl-4-phenylaniline
SMILESc1ccc(-c2ccc(NC3CC3)cc2)cc1
InChIInChI=1S/C15H15N/c1-2-4-12(5-3-1)13-6-8-14(9-7-13)16-15-10-11-15/h1-9,15-16H,10-11H2
InChIKeyNIUXNLHKQMSTQS-UHFFFAOYSA-N
XLogP3.93
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze N-cyclopropyl-4-phenylaniline 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-cyclopropyl-4-phenylaniline?
The IUPAC name of N-cyclopropyl-4-phenylaniline (CID 83702708) is N-cyclopropyl-4-phenylaniline.
What is the SMILES notation for N-cyclopropyl-4-phenylaniline?
The canonical SMILES for N-cyclopropyl-4-phenylaniline is c1ccc(-c2ccc(NC3CC3)cc2)cc1.
What is the InChIKey of N-cyclopropyl-4-phenylaniline?
The InChIKey is NIUXNLHKQMSTQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H15N/c1-2-4-12(5-3-1)13-6-8-14(9-7-13)16-15-10-11-15/h1-9,15-16H,10-11H2.
What are the key properties of N-cyclopropyl-4-phenylaniline?
N-cyclopropyl-4-phenylaniline has a molecular weight of 209.29 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-4-phenylaniline is sourced from PubChem (CID 83702708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).