(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide

C14H19NO2 — CID 40532664

IUPAC(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
SMILESCC(C)c1ccccc1NC(=O)[C@@H]1CCCO1
InChIInChI=1S/C14H19NO2/c1-10(2)11-6-3-4-7-12(11)15-14(16)13-8-5-9-17-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H,15,16)/t13-/m0/s1
InChIKeyMCYFYOCUNCVYQJ-ZDUSSCGKSA-N
MW233.31 g/mol
LogP2.93
Rot. Bonds3

About (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide

(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide (PubChem CID 40532664) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound Name(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
PubChem CID40532664
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
SMILESCC(C)c1ccccc1NC(=O)[C@@H]1CCCO1
InChIInChI=1S/C14H19NO2/c1-10(2)11-6-3-4-7-12(11)15-14(16)13-8-5-9-17-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H,15,16)/t13-/m0/s1
InChIKeyMCYFYOCUNCVYQJ-ZDUSSCGKSA-N
XLogP2.93
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2S)-N-(2-propan-2-ylphenyl)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-[2-oxo-2-(2-propan-2-ylanilino)ethyl]oxolane-2-carboxamide
CID 112997084
1-(oxolan-2-yl)-3-(2-propan-2-ylphenyl)urea
CID 110706700
N-(2-phenylphenyl)oxolane-2-carboxamide
CID 2995133
(2S)-N-[2-tert-butyl-3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 58409794
N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide
CID 64793799
N-(2-cyanophenyl)oxolane-2-carboxamide
CID 2948515
2-[2-[[(2S)-oxolane-2-carbonyl]amino]phenyl]acetic acid
CID 104855642
N-(2-phenylsulfanylphenyl)oxolane-2-carboxamide
CID 2973789
N-[2-[(2-aminoacetyl)amino]phenyl]oxolane-2-carboxamide
CID 82034964
N-phenyloxolane-2-carboxamide
CID 3453643
N-(2-bromophenyl)oxane-2-carboxamide
CID 62214619
4-N-propan-2-yl-1-N-(2-propan-2-ylphenyl)cyclohexane-1,4-dicarboxamide
CID 109144556

Frequently Asked Questions

What is the IUPAC name of (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide?
The IUPAC name of (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide (CID 40532664) is (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide?
The canonical SMILES for (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide is CC(C)c1ccccc1NC(=O)[C@@H]1CCCO1.
What is the InChIKey of (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide?
The InChIKey is MCYFYOCUNCVYQJ-ZDUSSCGKSA-N. The full InChI is InChI=1S/C14H19NO2/c1-10(2)11-6-3-4-7-12(11)15-14(16)13-8-5-9-17-13/h3-4,6-7,10,13H,5,8-9H2,1-2H3,(H,15,16)/t13-/m0/s1.
What are the key properties of (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide?
(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide has a molecular weight of 233.31 g/mol, XLogP of 2.93, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 40532664), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).