N-cyclohexyl-N-(2-phenylethyl)formamide

C15H21NO — CID 87224609

IUPACN-cyclohexyl-N-(2-phenylethyl)formamide
SMILESO=CN(CCc1ccccc1)C1CCCCC1
InChIInChI=1S/C15H21NO/c17-13-16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1,3-4,7-8,13,15H,2,5-6,9-12H2
InChIKeyJTFGQSFQIMCZNS-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.02
Rot. Bonds5

About N-cyclohexyl-N-(2-phenylethyl)formamide

N-cyclohexyl-N-(2-phenylethyl)formamide (PubChem CID 87224609) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-cyclohexyl-N-(2-phenylethyl)formamide.

Molecular Properties

Compound NameN-cyclohexyl-N-(2-phenylethyl)formamide
PubChem CID87224609
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-cyclohexyl-N-(2-phenylethyl)formamide
SMILESO=CN(CCc1ccccc1)C1CCCCC1
InChIInChI=1S/C15H21NO/c17-13-16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1,3-4,7-8,13,15H,2,5-6,9-12H2
InChIKeyJTFGQSFQIMCZNS-UHFFFAOYSA-N
XLogP3.02
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

Analyze N-cyclohexyl-N-(2-phenylethyl)formamide 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-cyclohexyl-N-(2-phenylethyl)formamide?
The IUPAC name of N-cyclohexyl-N-(2-phenylethyl)formamide (CID 87224609) is N-cyclohexyl-N-(2-phenylethyl)formamide.
What is the SMILES notation for N-cyclohexyl-N-(2-phenylethyl)formamide?
The canonical SMILES for N-cyclohexyl-N-(2-phenylethyl)formamide is O=CN(CCc1ccccc1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N-(2-phenylethyl)formamide?
The InChIKey is JTFGQSFQIMCZNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c17-13-16(15-9-5-2-6-10-15)12-11-14-7-3-1-4-8-14/h1,3-4,7-8,13,15H,2,5-6,9-12H2.
What are the key properties of N-cyclohexyl-N-(2-phenylethyl)formamide?
N-cyclohexyl-N-(2-phenylethyl)formamide has a molecular weight of 231.34 g/mol, XLogP of 3.02, 5 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N-(2-phenylethyl)formamide is sourced from PubChem (CID 87224609), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).