N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide

C14H19NO2 — CID 110779522

IUPACN-[(4-ethylphenyl)methyl]oxolane-2-carboxamide
SMILESCCc1ccc(CNC(=O)C2CCCO2)cc1
InChIInChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)10-15-14(16)13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16)
InChIKeyVJDWTJAMZNQRDX-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.04
Rot. Bonds4

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

N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide (PubChem CID 110779522) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[(4-ethylphenyl)methyl]oxolane-2-carboxamide
PubChem CID110779522
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC NameN-[(4-ethylphenyl)methyl]oxolane-2-carboxamide
SMILESCCc1ccc(CNC(=O)C2CCCO2)cc1
InChIInChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)10-15-14(16)13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16)
InChIKeyVJDWTJAMZNQRDX-UHFFFAOYSA-N
XLogP2.04
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze N-[(4-ethylphenyl)methyl]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

N-[(4-ethylsulfanylphenyl)methyl]oxolane-2-carboxamide
CID 110784547
N-[[4-(methylcarbamoyl)phenyl]methyl]oxolane-2-carboxamide
CID 47160865
N-[(4-butan-2-ylphenyl)methyl]oxolane-2-carboxamide
CID 110780449
N'-(4-ethylbenzoyl)oxolane-2-carbohydrazide
CID 47099547
N-[(4-morpholin-4-ylphenyl)methyl]oxolane-2-carboxamide
CID 110405121
N-[[4-[(4-methylpiperidin-1-yl)methyl]phenyl]methyl]oxolane-2-carboxamide
CID 42891527
(2R)-N-[[4-[(4-chlorophenyl)methylamino]phenyl]methyl]oxolane-2-carboxamide
CID 170159902
N-[[4-[(3,5-dimethylpiperidin-1-yl)methyl]phenyl]methyl]oxolane-2-carboxamide
CID 47042015
N-[1-(4-ethylphenyl)-2-methylpropyl]oxolane-2-carboxamide
CID 78810784
N-[(1,3-dimethyl-2-oxobenzimidazol-5-yl)methyl]oxolane-2-carboxamide
CID 110785343
N-[[3-[(oxane-2-carbonylamino)methyl]phenyl]methyl]oxane-2-carboxamide
CID 127697163
N-[[3-(hydroxymethyl)phenyl]methyl]oxolane-2-carboxamide
CID 63311174

Frequently Asked Questions

What is the IUPAC name of N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide?
The IUPAC name of N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide (CID 110779522) is N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide?
The canonical SMILES for N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide is CCc1ccc(CNC(=O)C2CCCO2)cc1.
What is the InChIKey of N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide?
The InChIKey is VJDWTJAMZNQRDX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-2-11-5-7-12(8-6-11)10-15-14(16)13-4-3-9-17-13/h5-8,13H,2-4,9-10H2,1H3,(H,15,16).
What are the key properties of N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide?
N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.04, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(4-ethylphenyl)methyl]oxolane-2-carboxamide is sourced from PubChem (CID 110779522), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).