N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide

C15H21NO3 — CID 105059163

IUPACN-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide
SMILESCC1(C(=O)NC(C)(CO)c2ccccc2)CCCO1
InChIInChI=1S/C15H21NO3/c1-14(11-17,12-7-4-3-5-8-12)16-13(18)15(2)9-6-10-19-15/h3-5,7-8,17H,6,9-11H2,1-2H3,(H,16,18)
InChIKeyLTIJQAPKKYCVRU-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.58
Rot. Bonds4

About N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide

N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide (PubChem CID 105059163) has the molecular formula C15H21NO3 and a molecular weight of 263.34 g/mol. Its IUPAC name is N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide
PubChem CID105059163
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide
SMILESCC1(C(=O)NC(C)(CO)c2ccccc2)CCCO1
InChIInChI=1S/C15H21NO3/c1-14(11-17,12-7-4-3-5-8-12)16-13(18)15(2)9-6-10-19-15/h3-5,7-8,17H,6,9-11H2,1-2H3,(H,16,18)
InChIKeyLTIJQAPKKYCVRU-UHFFFAOYSA-N
XLogP1.58
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.34
LogP ≤ 51.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-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

5-(4-Fluorophenyl)-5-(hydroxymethyl)pyrrolidin-2-one
CID 142011854
N-[1-(4-fluorophenyl)cyclobutyl]oxolane-2-carboxamide
CID 48033465
N-[4-(3-fluorophenyl)oxan-4-yl]oxolane-2-carboxamide
CID 72118436
N-(1-hydroxy-2-phenylpropan-2-yl)-2-(2,2,2-trifluoroethoxy)acetamide
CID 103209200
N-[2-hydroxy-1-(3,4,5-trifluorophenyl)ethyl]oxolane-2-carboxamide
CID 109627295
N-[2-hydroxy-1-(3,4,5-trifluorophenyl)ethyl]-3-methyloxolane-2-carboxamide
CID 109944484
N-[2-(4-fluorophenyl)propan-2-yl]oxolane-2-carboxamide
CID 110444558
N-[1-(4-fluorophenyl)cyclopropyl]oxolane-2-carboxamide
CID 110444559
N-[2-(2-fluorophenyl)propan-2-yl]oxolane-2-carboxamide
CID 110444561
N-[1-(2-fluorophenyl)cyclopentyl]oxolane-2-carboxamide
CID 110444562
2-(4-Fluorophenyl)-2-(oxolane-2-carbonylamino)propanoic acid
CID 121973130
2-(4-fluorophenyl)-2-[[(2S)-oxolane-2-carbonyl]amino]propanoic acid
CID 121973649

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide?
The IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide (CID 105059163) is N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide is CC1(C(=O)NC(C)(CO)c2ccccc2)CCCO1.
What is the InChIKey of N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide?
The InChIKey is LTIJQAPKKYCVRU-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-14(11-17,12-7-4-3-5-8-12)16-13(18)15(2)9-6-10-19-15/h3-5,7-8,17H,6,9-11H2,1-2H3,(H,16,18).
What are the key properties of N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide?
N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.58, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxy-2-phenylpropan-2-yl)-2-methyloxolane-2-carboxamide is sourced from PubChem (CID 105059163), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).