N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide

C14H18N2O4 — CID 78845452

IUPACN-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide
SMILESO=C(NCCO)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C14H18N2O4/c17-7-6-15-13(18)10-3-1-4-11(9-10)16-14(19)12-5-2-8-20-12/h1,3-4,9,12,17H,2,5-8H2,(H,15,18)(H,16,19)
InChIKeyUDYQISNJACIEFE-UHFFFAOYSA-N
MW278.31 g/mol
LogP0.53
Rot. Bonds5

About N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide

N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide (PubChem CID 78845452) has the molecular formula C14H18N2O4 and a molecular weight of 278.31 g/mol. Its IUPAC name is N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide.

Molecular Properties

Compound NameN-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide
PubChem CID78845452
Molecular FormulaC14H18N2O4
Molecular Weight278.31 g/mol
Exact Mass278.13
IUPAC NameN-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide
SMILESO=C(NCCO)c1cccc(NC(=O)C2CCCO2)c1
InChIInChI=1S/C14H18N2O4/c17-7-6-15-13(18)10-3-1-4-11(9-10)16-14(19)12-5-2-8-20-12/h1,3-4,9,12,17H,2,5-8H2,(H,15,18)(H,16,19)
InChIKeyUDYQISNJACIEFE-UHFFFAOYSA-N
XLogP0.53
TPSA87.66 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.31
LogP ≤ 50.53
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[2-(methylamino)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 119504077
N-[3-(2-cyclopentylethylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 42884229
N-[3-(benzylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 2971215
N-[3-[2-(4-tert-butylphenyl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 46442303
(2S)-N-[3-[[(2S)-oxolane-2-carbonyl]amino]phenyl]oxolane-2-carboxamide
CID 7027817
(2R)-N-[3-[2-(2,3-dihydro-1,4-benzodioxin-6-yl)ethylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 52509495
N-[3-(thiophen-2-ylmethylcarbamoyl)phenyl]oxolane-2-carboxamide
CID 42889236
3-[[(2S)-oxolane-2-carbonyl]amino]benzoic acid
CID 839554
N-[3-[[3-(butan-2-ylamino)-3-oxopropyl]carbamoyl]phenyl]oxolane-2-carboxamide
CID 55948043
N-[3-[(2-amino-2-ethylbutyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 119643641
N-[3-[[3-(methylcarbamoyl)phenyl]methylcarbamoyl]phenyl]oxolane-2-carboxamide
CID 46592689
N-[3-[(4-aminocyclohexyl)carbamoyl]phenyl]oxolane-2-carboxamide
CID 119478775

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide?
The IUPAC name of N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide (CID 78845452) is N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide.
What is the SMILES notation for N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide?
The canonical SMILES for N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide is O=C(NCCO)c1cccc(NC(=O)C2CCCO2)c1.
What is the InChIKey of N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide?
The InChIKey is UDYQISNJACIEFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O4/c17-7-6-15-13(18)10-3-1-4-11(9-10)16-14(19)12-5-2-8-20-12/h1,3-4,9,12,17H,2,5-8H2,(H,15,18)(H,16,19).
What are the key properties of N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide?
N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide has a molecular weight of 278.31 g/mol, XLogP of 0.53, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-hydroxyethylcarbamoyl)phenyl]oxolane-2-carboxamide is sourced from PubChem (CID 78845452), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).