N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide

C12H15NO3 — CID 64793799

IUPACN-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide
SMILESCc1c(O)cccc1NC(=O)C1CCCO1
InChIInChI=1S/C12H15NO3/c1-8-9(4-2-5-10(8)14)13-12(15)11-6-3-7-16-11/h2,4-5,11,14H,3,6-7H2,1H3,(H,13,15)
InChIKeyQADIHLGNVXNVFX-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.82
Rot. Bonds2

About N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide

N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide (PubChem CID 64793799) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide
PubChem CID64793799
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC NameN-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide
SMILESCc1c(O)cccc1NC(=O)C1CCCO1
InChIInChI=1S/C12H15NO3/c1-8-9(4-2-5-10(8)14)13-12(15)11-6-3-7-16-11/h2,4-5,11,14H,3,6-7H2,1H3,(H,13,15)
InChIKeyQADIHLGNVXNVFX-UHFFFAOYSA-N
XLogP1.82
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500221.26
LogP ≤ 51.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-3-[[(2R)-oxolane-2-carbonyl]amino]benzoic acid
CID 7248012
N-(3-chloro-2-methylphenyl)oxane-2-carboxamide
CID 110859024
(2S)-N-[2-tert-butyl-3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 58409794
N-(2,6-dimethylphenyl)oxolane-2-carboxamide
CID 3155119
N-(2,3-dichlorophenyl)oxolane-2-carboxamide
CID 3155144
N-(5,6,7,8-tetrahydronaphthalen-1-yl)oxolane-2-carboxamide
CID 42904447
(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
CID 40532664
N-(1-methylisoquinolin-5-yl)oxolane-2-carboxamide
CID 154789089
N-[3-(1,3-benzoxazol-2-yl)-2-methylphenyl]oxolane-2-carboxamide
CID 17361713
N-(2-phenylphenyl)oxolane-2-carboxamide
CID 2995133
(2S)-N-[4-methyl-2-[[(2R)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7926588
(2S)-N-(2-bromo-3-chlorophenyl)oxolane-2-carboxamide
CID 103479904

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide?
The IUPAC name of N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide (CID 64793799) is N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide is Cc1c(O)cccc1NC(=O)C1CCCO1.
What is the InChIKey of N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide?
The InChIKey is QADIHLGNVXNVFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-8-9(4-2-5-10(8)14)13-12(15)11-6-3-7-16-11/h2,4-5,11,14H,3,6-7H2,1H3,(H,13,15).
What are the key properties of N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide?
N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 1.82, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxy-2-methylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 64793799), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).