N-(2-carbamoylphenyl)oxolane-2-carboxamide

C12H14N2O3 — CID 2862859

IUPACN-(2-carbamoylphenyl)oxolane-2-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)C1CCCO1
InChIInChI=1S/C12H14N2O3/c13-11(15)8-4-1-2-5-9(8)14-12(16)10-6-3-7-17-10/h1-2,4-5,10H,3,6-7H2,(H2,13,15)(H,14,16)
InChIKeyXPVPZZNYUPSRMM-UHFFFAOYSA-N
MW234.25 g/mol
LogP0.90
Rot. Bonds3

About N-(2-carbamoylphenyl)oxolane-2-carboxamide

N-(2-carbamoylphenyl)oxolane-2-carboxamide (PubChem CID 2862859) has the molecular formula C12H14N2O3 and a molecular weight of 234.25 g/mol. Its IUPAC name is N-(2-carbamoylphenyl)oxolane-2-carboxamide.

Molecular Properties

Compound NameN-(2-carbamoylphenyl)oxolane-2-carboxamide
PubChem CID2862859
Molecular FormulaC12H14N2O3
Molecular Weight234.25 g/mol
Exact Mass234.10
IUPAC NameN-(2-carbamoylphenyl)oxolane-2-carboxamide
SMILESNC(=O)c1ccccc1NC(=O)C1CCCO1
InChIInChI=1S/C12H14N2O3/c13-11(15)8-4-1-2-5-9(8)14-12(16)10-6-3-7-17-10/h1-2,4-5,10H,3,6-7H2,(H2,13,15)(H,14,16)
InChIKeyXPVPZZNYUPSRMM-UHFFFAOYSA-N
XLogP0.90
TPSA81.42 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.25
LogP ≤ 50.90
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-carbamoylphenyl)oxolane-2-carboxamide?
The IUPAC name of N-(2-carbamoylphenyl)oxolane-2-carboxamide (CID 2862859) is N-(2-carbamoylphenyl)oxolane-2-carboxamide.
What is the SMILES notation for N-(2-carbamoylphenyl)oxolane-2-carboxamide?
The canonical SMILES for N-(2-carbamoylphenyl)oxolane-2-carboxamide is NC(=O)c1ccccc1NC(=O)C1CCCO1.
What is the InChIKey of N-(2-carbamoylphenyl)oxolane-2-carboxamide?
The InChIKey is XPVPZZNYUPSRMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H14N2O3/c13-11(15)8-4-1-2-5-9(8)14-12(16)10-6-3-7-17-10/h1-2,4-5,10H,3,6-7H2,(H2,13,15)(H,14,16).
What are the key properties of N-(2-carbamoylphenyl)oxolane-2-carboxamide?
N-(2-carbamoylphenyl)oxolane-2-carboxamide has a molecular weight of 234.25 g/mol, XLogP of 0.90, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-carbamoylphenyl)oxolane-2-carboxamide is sourced from PubChem (CID 2862859), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).