N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide

C12H15NO3 — CID 81330062

IUPACN-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2cccc(O)c2)O1
InChIInChI=1S/C12H15NO3/c1-8-5-6-11(16-8)12(15)13-9-3-2-4-10(14)7-9/h2-4,7-8,11,14H,5-6H2,1H3,(H,13,15)
InChIKeyTUCHIVWALHPTLM-UHFFFAOYSA-N
MW221.26 g/mol
LogP1.90
Rot. Bonds2

About N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide

N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide (PubChem CID 81330062) has the molecular formula C12H15NO3 and a molecular weight of 221.26 g/mol. Its IUPAC name is N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide.

Molecular Properties

Compound NameN-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide
PubChem CID81330062
Molecular FormulaC12H15NO3
Molecular Weight221.26 g/mol
Exact Mass221.11
IUPAC NameN-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide
SMILESCC1CCC(C(=O)Nc2cccc(O)c2)O1
InChIInChI=1S/C12H15NO3/c1-8-5-6-11(16-8)12(15)13-9-3-2-4-10(14)7-9/h2-4,7-8,11,14H,5-6H2,1H3,(H,13,15)
InChIKeyTUCHIVWALHPTLM-UHFFFAOYSA-N
XLogP1.90
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 ≤ 51.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2S,5R)-5-(aminomethyl)-N-(3-hydroxyphenyl)oxolane-2-carboxamide;hydrochloride
CID 120801761
5-hydroxy-2-[(5-methyloxolane-2-carbonyl)amino]benzoic acid
CID 81325335
N-(3-hydroxyphenyl)-4-methylcyclohexane-1-carboxamide
CID 113287962
N-(4-bromophenyl)-5-methyloxolane-2-carboxamide
CID 80949197
5-methyl-N-[3-[1-(propylamino)ethyl]phenyl]oxolane-2-carboxamide
CID 81316838
N-[3-[(2Z)-2-amino-2-hydroxyiminoethoxy]phenyl]-5-methyloxolane-2-carboxamide
CID 81330665
(5R)-N-[2-(hydroxymethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211610
5-methyl-N-[2-(methylaminomethyl)-4-pyridinyl]oxolane-2-carboxamide
CID 166160576
N-[4-(bromomethyl)phenyl]-5-methyloxolane-2-carboxamide
CID 114310972
N-(6-amino-3-pyridinyl)-5-methyloxolane-2-carboxamide
CID 81331226
N-[2-[acetyl(methyl)amino]-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 166160944
N-[2-(2-fluoro-1-hydroxyethyl)-4-pyridinyl]-5-methyloxolane-2-carboxamide
CID 167211525

Frequently Asked Questions

What is the IUPAC name of N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide?
The IUPAC name of N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide (CID 81330062) is N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide.
What is the SMILES notation for N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide?
The canonical SMILES for N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide is CC1CCC(C(=O)Nc2cccc(O)c2)O1.
What is the InChIKey of N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide?
The InChIKey is TUCHIVWALHPTLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO3/c1-8-5-6-11(16-8)12(15)13-9-3-2-4-10(14)7-9/h2-4,7-8,11,14H,5-6H2,1H3,(H,13,15).
What are the key properties of N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide?
N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide has a molecular weight of 221.26 g/mol, XLogP of 1.90, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-hydroxyphenyl)-5-methyloxolane-2-carboxamide is sourced from PubChem (CID 81330062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).