N-ethyl-N-phenylcyclobutanecarboxamide

C13H17NO — CID 39946342

IUPACN-ethyl-N-phenylcyclobutanecarboxamide
SMILESCCN(C(=O)C1CCC1)c1ccccc1
InChIInChI=1S/C13H17NO/c1-2-14(12-9-4-3-5-10-12)13(15)11-7-6-8-11/h3-5,9-11H,2,6-8H2,1H3
InChIKeyMRIAUKUPYANJBD-UHFFFAOYSA-N
MW203.29 g/mol
LogP2.84
Rot. Bonds3

About N-ethyl-N-phenylcyclobutanecarboxamide

N-ethyl-N-phenylcyclobutanecarboxamide (PubChem CID 39946342) has the molecular formula C13H17NO and a molecular weight of 203.29 g/mol. Its IUPAC name is N-ethyl-N-phenylcyclobutanecarboxamide.

Molecular Properties

Compound NameN-ethyl-N-phenylcyclobutanecarboxamide
PubChem CID39946342
Molecular FormulaC13H17NO
Molecular Weight203.29 g/mol
Exact Mass203.13
IUPAC NameN-ethyl-N-phenylcyclobutanecarboxamide
SMILESCCN(C(=O)C1CCC1)c1ccccc1
InChIInChI=1S/C13H17NO/c1-2-14(12-9-4-3-5-10-12)13(15)11-7-6-8-11/h3-5,9-11H,2,6-8H2,1H3
InChIKeyMRIAUKUPYANJBD-UHFFFAOYSA-N
XLogP2.84
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.29
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

N-ethyl-N-phenylcyclohexanecarboxamide
CID 3884538
4-[ethyl(phenyl)carbamoyl]cyclohexane-1-carboxylic acid
CID 63784653
N-ethyl-N-phenyloxane-3-carboxamide
CID 110857893
N-ethyl-N-(4-fluorophenyl)cyclobutanecarboxamide
CID 39964862
2-[ethyl(phenyl)carbamoyl]cyclopentane-1-carboxylic acid
CID 113360944
N-ethyl-1-methylsulfonyl-N-phenylpiperidine-4-carboxamide
CID 51320930
1-N-tert-butyl-4-N-ethyl-4-N-phenylcyclohexane-1,4-dicarboxamide
CID 109149575
N-ethyl-N-phenylpyrrolidine-3-carboxamide;hydrochloride
CID 119670332
N-ethyl-N-(3-methylphenyl)cyclohexanecarboxamide
CID 533210
N-ethyl-1-(2-methylpropanoyl)-N-phenylpiperidine-4-carboxamide
CID 113006682
N-ethyl-2-methyl-N-phenylpiperidine-4-carboxamide
CID 106738635
N-ethyl-6-methyl-N-phenylpiperidine-2-carboxamide
CID 24699676

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-phenylcyclobutanecarboxamide?
The IUPAC name of N-ethyl-N-phenylcyclobutanecarboxamide (CID 39946342) is N-ethyl-N-phenylcyclobutanecarboxamide.
What is the SMILES notation for N-ethyl-N-phenylcyclobutanecarboxamide?
The canonical SMILES for N-ethyl-N-phenylcyclobutanecarboxamide is CCN(C(=O)C1CCC1)c1ccccc1.
What is the InChIKey of N-ethyl-N-phenylcyclobutanecarboxamide?
The InChIKey is MRIAUKUPYANJBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-2-14(12-9-4-3-5-10-12)13(15)11-7-6-8-11/h3-5,9-11H,2,6-8H2,1H3.
What are the key properties of N-ethyl-N-phenylcyclobutanecarboxamide?
N-ethyl-N-phenylcyclobutanecarboxamide has a molecular weight of 203.29 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-phenylcyclobutanecarboxamide is sourced from PubChem (CID 39946342), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).