4-acetamido-N-formylbenzamide

C10H10N2O3 — CID 89378882

IUPAC4-acetamido-N-formylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)NC=O)cc1
InChIInChI=1S/C10H10N2O3/c1-7(14)12-9-4-2-8(3-5-9)10(15)11-6-13/h2-6H,1H3,(H,12,14)(H,11,13,15)
InChIKeyHYKBBCWLHLNGFV-UHFFFAOYSA-N
MW206.20 g/mol
LogP0.53
Rot. Bonds3

About 4-acetamido-N-formylbenzamide

4-acetamido-N-formylbenzamide (PubChem CID 89378882) has the molecular formula C10H10N2O3 and a molecular weight of 206.20 g/mol. Its IUPAC name is 4-acetamido-N-formylbenzamide.

Molecular Properties

Compound Name4-acetamido-N-formylbenzamide
PubChem CID89378882
Molecular FormulaC10H10N2O3
Molecular Weight206.20 g/mol
Exact Mass206.07
IUPAC Name4-acetamido-N-formylbenzamide
SMILESCC(=O)Nc1ccc(C(=O)NC=O)cc1
InChIInChI=1S/C10H10N2O3/c1-7(14)12-9-4-2-8(3-5-9)10(15)11-6-13/h2-6H,1H3,(H,12,14)(H,11,13,15)
InChIKeyHYKBBCWLHLNGFV-UHFFFAOYSA-N
XLogP0.53
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500206.20
LogP ≤ 50.53
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'aldehyde', 'substructure': 'N/A'}

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Related Compounds

N-[4-[(4-acetamidophenyl)carbamoyl]phenyl]-4-methylbenzamide
CID 2223178
4-[[4-[(4-acetamidobenzoyl)amino]benzoyl]amino]benzoic acid
CID 155141284
4-N-(4-acetamidophenyl)benzene-1,4-dicarboxamide
CID 27648779
4-acetamido-N-[4-[(4-acetamidophenyl)diazenyl]phenyl]benzamide
CID 130360401
N-(4-acetylphenyl)acetamide;fluoromethane
CID 160517938
4-acetamidobenzenecarbothioic S-acid
CID 86154982
4-acetamidobenzoyl chloride
CID 7010341
N-[4-(4-iodobenzoyl)phenyl]acetamide
CID 43337938
N-(4-acetamidophenyl)-3-iodo-4-methylbenzamide
CID 1014195
4-acetamido-N-cyclooctylbenzamide
CID 2990044
1-N-(4-acetamidophenyl)-4-N,4-N-diethylbenzene-1,4-dicarboxamide
CID 109048426
4-N-(4-acetamidophenyl)-1-N-prop-2-enylbenzene-1,4-dicarboxamide
CID 109043595

Frequently Asked Questions

What is the IUPAC name of 4-acetamido-N-formylbenzamide?
The IUPAC name of 4-acetamido-N-formylbenzamide (CID 89378882) is 4-acetamido-N-formylbenzamide.
What is the SMILES notation for 4-acetamido-N-formylbenzamide?
The canonical SMILES for 4-acetamido-N-formylbenzamide is CC(=O)Nc1ccc(C(=O)NC=O)cc1.
What is the InChIKey of 4-acetamido-N-formylbenzamide?
The InChIKey is HYKBBCWLHLNGFV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10N2O3/c1-7(14)12-9-4-2-8(3-5-9)10(15)11-6-13/h2-6H,1H3,(H,12,14)(H,11,13,15).
What are the key properties of 4-acetamido-N-formylbenzamide?
4-acetamido-N-formylbenzamide has a molecular weight of 206.20 g/mol, XLogP of 0.53, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-acetamido-N-formylbenzamide is sourced from PubChem (CID 89378882), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).