N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide

C14H19NO3 — CID 79757811

IUPACN-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide
SMILESCC(O)c1ccccc1NC(=O)C1CCOC1C
InChIInChI=1S/C14H19NO3/c1-9(16)11-5-3-4-6-13(11)15-14(17)12-7-8-18-10(12)2/h3-6,9-10,12,16H,7-8H2,1-2H3,(H,15,17)
InChIKeySGCGFFFACYCWNM-UHFFFAOYSA-N
MW249.31 g/mol
LogP2.10
Rot. Bonds3

About N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide

N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide (PubChem CID 79757811) has the molecular formula C14H19NO3 and a molecular weight of 249.31 g/mol. Its IUPAC name is N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide.

Molecular Properties

Compound NameN-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide
PubChem CID79757811
Molecular FormulaC14H19NO3
Molecular Weight249.31 g/mol
Exact Mass249.14
IUPAC NameN-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide
SMILESCC(O)c1ccccc1NC(=O)C1CCOC1C
InChIInChI=1S/C14H19NO3/c1-9(16)11-5-3-4-6-13(11)15-14(17)12-7-8-18-10(12)2/h3-6,9-10,12,16H,7-8H2,1-2H3,(H,15,17)
InChIKeySGCGFFFACYCWNM-UHFFFAOYSA-N
XLogP2.10
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 52.10
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(bromomethyl)phenyl]-2-methyloxolane-3-carboxamide
CID 114309567
2-methyl-N-phenyloxolane-3-carboxamide
CID 79758849
N-[4-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide
CID 79759025
N-[2-(N'-hydroxycarbamimidoyl)phenyl]-2-methyloxolane-3-carboxamide
CID 79763446
(2S,3S)-2-methyl-N-quinolin-4-yloxolane-3-carboxamide
CID 166298277
(2S,3S)-N-(2-ethyl-1,3-dihydroisoindol-4-yl)-2-methyloxolane-3-carboxamide
CID 124739506
2-methyl-N-(2-methyl-1,2,3,4-tetrahydroquinolin-8-yl)oxolane-3-carboxamide
CID 79759818
(2R)-N-[2-(1-hydroxyethyl)phenyl]pyrrolidine-2-carboxamide
CID 104901084
N-[2-(1-chloroethyl)phenyl]-2-methylcyclopentane-1-carboxamide
CID 107184100
N-(2-amino-4-methylphenyl)-2-methyloxolane-3-carboxamide
CID 79750828
N-[2-(1-chloroethyl)phenyl]-2-methylcyclopropane-1-carboxamide
CID 114304921
(2S)-N-(2-propan-2-ylphenyl)oxolane-2-carboxamide
CID 40532664

Frequently Asked Questions

What is the IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide?
The IUPAC name of N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide (CID 79757811) is N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide.
What is the SMILES notation for N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide?
The canonical SMILES for N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide is CC(O)c1ccccc1NC(=O)C1CCOC1C.
What is the InChIKey of N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide?
The InChIKey is SGCGFFFACYCWNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO3/c1-9(16)11-5-3-4-6-13(11)15-14(17)12-7-8-18-10(12)2/h3-6,9-10,12,16H,7-8H2,1-2H3,(H,15,17).
What are the key properties of N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide?
N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide has a molecular weight of 249.31 g/mol, XLogP of 2.10, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1-hydroxyethyl)phenyl]-2-methyloxolane-3-carboxamide is sourced from PubChem (CID 79757811), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).