2,3-dihydroxy-N-prop-2-enylbenzamide

C10H11NO3 — CID 67915131

IUPAC2,3-dihydroxy-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1cccc(O)c1O
InChIInChI=1S/C10H11NO3/c1-2-6-11-10(14)7-4-3-5-8(12)9(7)13/h2-5,12-13H,1,6H2,(H,11,14)
InChIKeyZWRPKWXTWIWTQG-UHFFFAOYSA-N
MW193.20 g/mol
LogP1.01
Rot. Bonds3

About 2,3-dihydroxy-N-prop-2-enylbenzamide

2,3-dihydroxy-N-prop-2-enylbenzamide (PubChem CID 67915131) has the molecular formula C10H11NO3 and a molecular weight of 193.20 g/mol. Its IUPAC name is 2,3-dihydroxy-N-prop-2-enylbenzamide.

Molecular Properties

Compound Name2,3-dihydroxy-N-prop-2-enylbenzamide
PubChem CID67915131
Molecular FormulaC10H11NO3
Molecular Weight193.20 g/mol
Exact Mass193.07
IUPAC Name2,3-dihydroxy-N-prop-2-enylbenzamide
SMILESC=CCNC(=O)c1cccc(O)c1O
InChIInChI=1S/C10H11NO3/c1-2-6-11-10(14)7-4-3-5-8(12)9(7)13/h2-5,12-13H,1,6H2,(H,11,14)
InChIKeyZWRPKWXTWIWTQG-UHFFFAOYSA-N
XLogP1.01
TPSA69.56 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'catechol_A(92)', 'substructure': 'N/A'}, {'alert_name': 'catechol', 'substructure': 'N/A'}, {'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 2,3-dihydroxy-N-prop-2-enylbenzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

2,4-dihydroxy-N-prop-2-enylbenzamide
CID 103608413
2-fluoro-N-prop-2-enylbenzamide
CID 4125319
3-amino-2-chloro-N-prop-2-enylbenzamide
CID 112575204
3-amino-2-methyl-N-prop-2-enylbenzamide
CID 28723067
2-methoxy-N-prop-2-enylbenzamide
CID 4063222
N-(2-fluoroethyl)-2,3-dihydroxybenzamide
CID 130478170
4-[4-carboxy-3-(prop-2-enylcarbamoyl)phenyl]-2-(prop-2-enylcarbamoyl)benzoic acid
CID 70576867
2-methylsulfonyl-N-prop-2-enylbenzamide
CID 31301978
N-[2-(prop-2-enylcarbamoyl)phenyl]naphthalene-1-carboxamide
CID 2174448
3-[(2,3-dihydroxybenzoyl)amino]propanoic acid
CID 114343241
N-prop-2-enyl-2-(prop-2-enylamino)pyridine-3-carboxamide
CID 118705755
4-[4-carbamoyl-3-(prop-2-enylcarbamoyl)benzenecarboximidoyl]-2-N-prop-2-enylbenzene-1,2-dicarboxamide
CID 88514136

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydroxy-N-prop-2-enylbenzamide?
The IUPAC name of 2,3-dihydroxy-N-prop-2-enylbenzamide (CID 67915131) is 2,3-dihydroxy-N-prop-2-enylbenzamide.
What is the SMILES notation for 2,3-dihydroxy-N-prop-2-enylbenzamide?
The canonical SMILES for 2,3-dihydroxy-N-prop-2-enylbenzamide is C=CCNC(=O)c1cccc(O)c1O.
What is the InChIKey of 2,3-dihydroxy-N-prop-2-enylbenzamide?
The InChIKey is ZWRPKWXTWIWTQG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO3/c1-2-6-11-10(14)7-4-3-5-8(12)9(7)13/h2-5,12-13H,1,6H2,(H,11,14).
What are the key properties of 2,3-dihydroxy-N-prop-2-enylbenzamide?
2,3-dihydroxy-N-prop-2-enylbenzamide has a molecular weight of 193.20 g/mol, XLogP of 1.01, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydroxy-N-prop-2-enylbenzamide is sourced from PubChem (CID 67915131), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).