N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide

C15H21NO3 — CID 105058923

IUPACN-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide
SMILESCC1CC(C(=O)NC(C)(CO)c2ccccc2)CO1
InChIInChI=1S/C15H21NO3/c1-11-8-12(9-19-11)14(18)16-15(2,10-17)13-6-4-3-5-7-13/h3-7,11-12,17H,8-10H2,1-2H3,(H,16,18)
InChIKeyGFJUHDJJVJYBRY-UHFFFAOYSA-N
MW263.34 g/mol
LogP1.44
Rot. Bonds4

About N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide

N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide (PubChem CID 105058923) 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)-5-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide
PubChem CID105058923
Molecular FormulaC15H21NO3
Molecular Weight263.34 g/mol
Exact Mass263.15
IUPAC NameN-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide
SMILESCC1CC(C(=O)NC(C)(CO)c2ccccc2)CO1
InChIInChI=1S/C15H21NO3/c1-11-8-12(9-19-11)14(18)16-15(2,10-17)13-6-4-3-5-7-13/h3-7,11-12,17H,8-10H2,1-2H3,(H,16,18)
InChIKeyGFJUHDJJVJYBRY-UHFFFAOYSA-N
XLogP1.44
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 ≤ 51.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-hydroxy-2-phenylpropan-2-yl)-1-methyl-5-oxopyrrolidine-3-carboxamide
CID 105058823
N-(3-hydroxy-2-methylbutan-2-yl)-5-methyloxolane-3-carboxamide
CID 114826272
N-(1-bromo-2-phenylpropan-2-yl)-2-methylcyclopropane-1-carboxamide
CID 105059964
(1-hydroxy-2-phenylpropan-2-yl)urea
CID 105059189
N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058812
N-(2-amino-1-phenylethyl)-5-methyloxolane-3-carboxamide
CID 114823482
N-(1-hydroxy-2-phenylpropan-2-yl)piperidine-2-carboxamide
CID 105058124
(2R)-2-[(5-methyloxolane-3-carbonyl)amino]-3-phenylpropanoic acid
CID 104979108
N-(1-bromo-2-phenylpropan-2-yl)cycloheptanecarboxamide
CID 105060197
N-(1-chloro-2-phenylpropan-2-yl)cyclooctanecarboxamide
CID 105059845
1-(4-chlorophenyl)-3-(1-hydroxy-2-phenylpropan-2-yl)urea
CID 115621952
3-amino-N-(1-hydroxy-2-phenylpropan-2-yl)propanamide
CID 105058260

Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide?
The IUPAC name of N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide (CID 105058923) is N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide.
What is the SMILES notation for N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide?
The canonical SMILES for N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide is CC1CC(C(=O)NC(C)(CO)c2ccccc2)CO1.
What is the InChIKey of N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide?
The InChIKey is GFJUHDJJVJYBRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21NO3/c1-11-8-12(9-19-11)14(18)16-15(2,10-17)13-6-4-3-5-7-13/h3-7,11-12,17H,8-10H2,1-2H3,(H,16,18).
What are the key properties of N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide?
N-(1-hydroxy-2-phenylpropan-2-yl)-5-methyloxolane-3-carboxamide has a molecular weight of 263.34 g/mol, XLogP of 1.44, 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)-5-methyloxolane-3-carboxamide is sourced from PubChem (CID 105058923), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).