phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate

C16H17NO3 — CID 105059186

IUPACphenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate
SMILESCC(CO)(NC(=O)Oc1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO3/c1-16(12-18,13-8-4-2-5-9-13)17-15(19)20-14-10-6-3-7-11-14/h2-11,18H,12H2,1H3,(H,17,19)
InChIKeyMGOFZQHKWUXAGX-UHFFFAOYSA-N
MW271.32 g/mol
LogP2.68
Rot. Bonds4

About phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate

phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate (PubChem CID 105059186) has the molecular formula C16H17NO3 and a molecular weight of 271.32 g/mol. Its IUPAC name is phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate.

Molecular Properties

Compound Namephenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate
PubChem CID105059186
Molecular FormulaC16H17NO3
Molecular Weight271.32 g/mol
Exact Mass271.12
IUPAC Namephenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate
SMILESCC(CO)(NC(=O)Oc1ccccc1)c1ccccc1
InChIInChI=1S/C16H17NO3/c1-16(12-18,13-8-4-2-5-9-13)17-15(19)20-14-10-6-3-7-11-14/h2-11,18H,12H2,1H3,(H,17,19)
InChIKeyMGOFZQHKWUXAGX-UHFFFAOYSA-N
XLogP2.68
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.68
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate 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

ethyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate
CID 105059191
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
2-(phenoxycarbonylamino)-2-phenylpropanoic acid
CID 62489572
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260
3-bromo-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105057894
2-methyl-2-(phenoxycarbonylamino)butanoic acid
CID 79793085
(E)-N-(1-hydroxy-2-phenylpropan-2-yl)but-2-enamide
CID 105057886
2,2,3-trimethyl-3-(phenoxycarbonylamino)butanoic acid
CID 65266350
N-(1-hydroxy-2-phenylpropan-2-yl)-3-methylpentanamide
CID 105058924
N-(1-hydroxy-2-phenylpropan-2-yl)-2-pyridin-4-ylacetamide
CID 105059171
1-(1-hydroxy-2-phenylpropan-2-yl)-3-propylurea
CID 115635344

Frequently Asked Questions

What is the IUPAC name of phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate?
The IUPAC name of phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate (CID 105059186) is phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate.
What is the SMILES notation for phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate?
The canonical SMILES for phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate is CC(CO)(NC(=O)Oc1ccccc1)c1ccccc1.
What is the InChIKey of phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate?
The InChIKey is MGOFZQHKWUXAGX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17NO3/c1-16(12-18,13-8-4-2-5-9-13)17-15(19)20-14-10-6-3-7-11-14/h2-11,18H,12H2,1H3,(H,17,19).
What are the key properties of phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate?
phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate has a molecular weight of 271.32 g/mol, XLogP of 2.68, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for phenyl N-(1-hydroxy-2-phenylpropan-2-yl)carbamate is sourced from PubChem (CID 105059186), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).