N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide

C15H21NO2 — CID 6464227

IUPACN-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide
SMILESCCc1ccc(C(C)NC(=O)C2CCCO2)cc1
InChIInChI=1S/C15H21NO2/c1-3-12-6-8-13(9-7-12)11(2)16-15(17)14-5-4-10-18-14/h6-9,11,14H,3-5,10H2,1-2H3,(H,16,17)
InChIKeyCRKWRKJYTWXEFR-UHFFFAOYSA-N
MW247.34 g/mol
LogP2.61
Rot. Bonds4

About N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide

N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide (PubChem CID 6464227) has the molecular formula C15H21NO2 and a molecular weight of 247.34 g/mol. Its IUPAC name is N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide
PubChem CID6464227
Molecular FormulaC15H21NO2
Molecular Weight247.34 g/mol
Exact Mass247.16
IUPAC NameN-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide
SMILESCCc1ccc(C(C)NC(=O)C2CCCO2)cc1
InChIInChI=1S/C15H21NO2/c1-3-12-6-8-13(9-7-12)11(2)16-15(17)14-5-4-10-18-14/h6-9,11,14H,3-5,10H2,1-2H3,(H,16,17)
InChIKeyCRKWRKJYTWXEFR-UHFFFAOYSA-N
XLogP2.61
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.34
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Acetamide, N-tetrahydrofurfuryl-2-phenyl-
CID 531986
[2-[(4-Methylphenyl)methylamino]-2-oxoethyl] cyclobutanecarboxylate
CID 2435628
Cambridge id 6878150
CID 2917394
N-(4-isopropylbenzyl)-N'-(tetrahydrofuran-2-ylmethyl)ethanediamide
CID 4314957
N-(1-phenylpropyl)tetrahydro-2-furancarboxamide
CID 6467126
N-(4-Methyl-benzyl)-N'-(tetrahydro-furan-2-ylmethyl)-oxalamide
CID 2891290
3-phenyl-N-(tetrahydro-2-furanylmethyl)butanamide
CID 2914304
N-[1-(3,4-dimethylphenyl)ethyl]tetrahydrofuran-2-carboxamide
CID 2970814
N-(oxolan-2-ylmethyl)-N'-(1-phenylethyl)oxamide
CID 2883263
N-[2-(4-fluorophenyl)ethyl]oxolane-2-carboxamide
CID 2947967
4-ethyl-N-{3-methyl-1-oxo-1-[(tetrahydrofuran-2-ylmethyl)amino]butan-2-yl}benzamide
CID 2975014
[2-Oxo-2-(1-phenylethylamino)ethyl] 2-methylcyclopropane-1-carboxylate
CID 3290911

Frequently Asked Questions

What is the IUPAC name of N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide?
The IUPAC name of N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide (CID 6464227) is N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide?
The canonical SMILES for N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide is CCc1ccc(C(C)NC(=O)C2CCCO2)cc1.
What is the InChIKey of N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide?
The InChIKey is CRKWRKJYTWXEFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO2/c1-3-12-6-8-13(9-7-12)11(2)16-15(17)14-5-4-10-18-14/h6-9,11,14H,3-5,10H2,1-2H3,(H,16,17).
What are the key properties of N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide?
N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide has a molecular weight of 247.34 g/mol, XLogP of 2.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-(4-ethylphenyl)ethyl]oxolane-2-carboxamide is sourced from PubChem (CID 6464227), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).