3-[(3-hydroxybenzoyl)amino]propanoic acid

C10H11NO4 — CID 16773120

IUPAC3-[(3-hydroxybenzoyl)amino]propanoic acid
SMILESO=C(O)CCNC(=O)c1cccc(O)c1
InChIInChI=1S/C10H11NO4/c12-8-3-1-2-7(6-8)10(15)11-5-4-9(13)14/h1-3,6,12H,4-5H2,(H,11,15)(H,13,14)
InChIKeyQFUNNWRGLZYTPR-UHFFFAOYSA-N
MW209.20 g/mol
LogP0.60
Rot. Bonds4

About 3-[(3-hydroxybenzoyl)amino]propanoic acid

3-[(3-hydroxybenzoyl)amino]propanoic acid (PubChem CID 16773120) has the molecular formula C10H11NO4 and a molecular weight of 209.20 g/mol. Its IUPAC name is 3-[(3-hydroxybenzoyl)amino]propanoic acid.

Molecular Properties

Compound Name3-[(3-hydroxybenzoyl)amino]propanoic acid
PubChem CID16773120
Molecular FormulaC10H11NO4
Molecular Weight209.20 g/mol
Exact Mass209.07
IUPAC Name3-[(3-hydroxybenzoyl)amino]propanoic acid
SMILESO=C(O)CCNC(=O)c1cccc(O)c1
InChIInChI=1S/C10H11NO4/c12-8-3-1-2-7(6-8)10(15)11-5-4-9(13)14/h1-3,6,12H,4-5H2,(H,11,15)(H,13,14)
InChIKeyQFUNNWRGLZYTPR-UHFFFAOYSA-N
XLogP0.60
TPSA86.63 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.20
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-bromoethyl)-3-hydroxybenzamide
CID 114307478
N-[2-(carbamoylamino)ethyl]-3-hydroxybenzamide
CID 83120683
8-[(3-hydroxybenzoyl)amino]octanoic acid;2-methylbutan-2-amine
CID 175439236
2-[(3-hydroxybenzoyl)amino]ethanesulfonic acid
CID 155758744
N-ethyl-3-hydroxybenzamide
CID 13175248
3-hydroxy-N-octylbenzamide
CID 115568584
2-hydroxy-N-[3-[(3-hydroxybenzoyl)amino]propyl]benzamide
CID 51105782
3-[[3-(2-methoxyethoxy)benzoyl]amino]propanoic acid
CID 119177030
N-[2-(2-aminoethoxy)ethyl]-3-hydroxybenzamide
CID 63754284
bis(3-benzamidopropanoic acid);piperazine
CID 3045072
3-[[3-(4-pyridin-4-ylpiperazin-1-yl)benzoyl]amino]propanoic acid
CID 57289759
N-(3-chloro-2,2-dimethylpropyl)-3-hydroxybenzamide
CID 115364515

Frequently Asked Questions

What is the IUPAC name of 3-[(3-hydroxybenzoyl)amino]propanoic acid?
The IUPAC name of 3-[(3-hydroxybenzoyl)amino]propanoic acid (CID 16773120) is 3-[(3-hydroxybenzoyl)amino]propanoic acid.
What is the SMILES notation for 3-[(3-hydroxybenzoyl)amino]propanoic acid?
The canonical SMILES for 3-[(3-hydroxybenzoyl)amino]propanoic acid is O=C(O)CCNC(=O)c1cccc(O)c1.
What is the InChIKey of 3-[(3-hydroxybenzoyl)amino]propanoic acid?
The InChIKey is QFUNNWRGLZYTPR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11NO4/c12-8-3-1-2-7(6-8)10(15)11-5-4-9(13)14/h1-3,6,12H,4-5H2,(H,11,15)(H,13,14).
What are the key properties of 3-[(3-hydroxybenzoyl)amino]propanoic acid?
3-[(3-hydroxybenzoyl)amino]propanoic acid has a molecular weight of 209.20 g/mol, XLogP of 0.60, 4 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(3-hydroxybenzoyl)amino]propanoic acid is sourced from PubChem (CID 16773120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).