N-ethyl-N-phenylcyclohexanecarboxamide

C15H21NO — CID 3884538

IUPACN-ethyl-N-phenylcyclohexanecarboxamide
SMILESCCN(C(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C15H21NO/c1-2-16(14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3
InChIKeyWNPYZECRLSOIRT-UHFFFAOYSA-N
MW231.34 g/mol
LogP3.62
Rot. Bonds3

About N-ethyl-N-phenylcyclohexanecarboxamide

N-ethyl-N-phenylcyclohexanecarboxamide (PubChem CID 3884538) has the molecular formula C15H21NO and a molecular weight of 231.34 g/mol. Its IUPAC name is N-ethyl-N-phenylcyclohexanecarboxamide.

Molecular Properties

Compound NameN-ethyl-N-phenylcyclohexanecarboxamide
PubChem CID3884538
Molecular FormulaC15H21NO
Molecular Weight231.34 g/mol
Exact Mass231.16
IUPAC NameN-ethyl-N-phenylcyclohexanecarboxamide
SMILESCCN(C(=O)C1CCCCC1)c1ccccc1
InChIInChI=1S/C15H21NO/c1-2-16(14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3
InChIKeyWNPYZECRLSOIRT-UHFFFAOYSA-N
XLogP3.62
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500231.34
LogP ≤ 53.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenylcyclohexanecarboxamide?
The IUPAC name of N-ethyl-N-phenylcyclohexanecarboxamide (CID 3884538) is N-ethyl-N-phenylcyclohexanecarboxamide.
What is the SMILES notation for N-ethyl-N-phenylcyclohexanecarboxamide?
The canonical SMILES for N-ethyl-N-phenylcyclohexanecarboxamide is CCN(C(=O)C1CCCCC1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenylcyclohexanecarboxamide?
The InChIKey is WNPYZECRLSOIRT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO/c1-2-16(14-11-7-4-8-12-14)15(17)13-9-5-3-6-10-13/h4,7-8,11-13H,2-3,5-6,9-10H2,1H3.
What are the key properties of N-ethyl-N-phenylcyclohexanecarboxamide?
N-ethyl-N-phenylcyclohexanecarboxamide has a molecular weight of 231.34 g/mol, XLogP of 3.62, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenylcyclohexanecarboxamide is sourced from PubChem (CID 3884538), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).