[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate

C16H14N2O5 — CID 7890744

IUPAC[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate
SMILESNC(=O)c1ccccc1NC(=O)COC(=O)c1ccccc1O
InChIInChI=1S/C16H14N2O5/c17-15(21)10-5-1-3-7-12(10)18-14(20)9-23-16(22)11-6-2-4-8-13(11)19/h1-8,19H,9H2,(H2,17,21)(H,18,20)
InChIKeyNROZDOGVYNXDOI-UHFFFAOYSA-N
MW314.30 g/mol
LogP1.29
Rot. Bonds5

About [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate

[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate (PubChem CID 7890744) has the molecular formula C16H14N2O5 and a molecular weight of 314.30 g/mol. Its IUPAC name is [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate.

Molecular Properties

Compound Name[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate
PubChem CID7890744
Molecular FormulaC16H14N2O5
Molecular Weight314.30 g/mol
Exact Mass314.09
IUPAC Name[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate
SMILESNC(=O)c1ccccc1NC(=O)COC(=O)c1ccccc1O
InChIInChI=1S/C16H14N2O5/c17-15(21)10-5-1-3-7-12(10)18-14(20)9-23-16(22)11-6-2-4-8-13(11)19/h1-8,19H,9H2,(H2,17,21)(H,18,20)
InChIKeyNROZDOGVYNXDOI-UHFFFAOYSA-N
XLogP1.29
TPSA118.72 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.30
LogP ≤ 51.29
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

[2-(3-chloro-2-methylanilino)-2-oxoethyl] 2-hydroxybenzoate
CID 7485087
[2-[(2-chloro-3-pyridinyl)amino]-2-oxoethyl] 2-hydroxybenzoate
CID 3362952
[2-(2-carbamoylanilino)-2-oxoethyl] 2,4,5-trimethoxybenzoate
CID 7395034
[2-(carbamoylamino)-2-oxoethyl] 2-hydroxybenzoate
CID 7890640
[2-(2-carbamoylanilino)-2-oxoethyl] 2,5-dimethylfuran-3-carboxylate
CID 7844551
[2-(2-carbamoylanilino)-2-oxoethyl] 2-chloro-4,5-difluorobenzoate
CID 7809950
[2-(2-acetylanilino)-2-oxoethyl] 2-hydroxy-4-methylbenzoate
CID 2611608
[2-(4-bromo-2-methylanilino)-2-oxoethyl] 2-hydroxybenzoate
CID 7485046
[2-(2-fluoroanilino)-2-oxoethyl] 2-hydroxy-4-methylbenzoate
CID 2611829
[2-(2-carbamoylanilino)-2-oxoethyl] 3-amino-4-chlorobenzoate
CID 7765030
[2-(2-fluoroanilino)-2-oxoethyl] 2-benzamidobenzoate
CID 4576263
2-(3-aminopropanoylamino)benzamide
CID 22692052

Frequently Asked Questions

What is the IUPAC name of [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate?
The IUPAC name of [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate (CID 7890744) is [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate.
What is the SMILES notation for [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate?
The canonical SMILES for [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate is NC(=O)c1ccccc1NC(=O)COC(=O)c1ccccc1O.
What is the InChIKey of [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate?
The InChIKey is NROZDOGVYNXDOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N2O5/c17-15(21)10-5-1-3-7-12(10)18-14(20)9-23-16(22)11-6-2-4-8-13(11)19/h1-8,19H,9H2,(H2,17,21)(H,18,20).
What are the key properties of [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate?
[2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate has a molecular weight of 314.30 g/mol, XLogP of 1.29, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-carbamoylanilino)-2-oxoethyl] 2-hydroxybenzoate is sourced from PubChem (CID 7890744), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).