2-(4-aminoanilino)acetamide

C8H11N3O — CID 19048353

IUPAC2-(4-aminoanilino)acetamide
SMILESNC(=O)CNc1ccc(N)cc1
InChIInChI=1S/C8H11N3O/c9-6-1-3-7(4-2-6)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12)
InChIKeySUVDKDKSNYZGFY-UHFFFAOYSA-N
MW165.20 g/mol
LogP0.17
Rot. Bonds3

About 2-(4-aminoanilino)acetamide

2-(4-aminoanilino)acetamide (PubChem CID 19048353) has the molecular formula C8H11N3O and a molecular weight of 165.20 g/mol. Its IUPAC name is 2-(4-aminoanilino)acetamide.

Molecular Properties

Compound Name2-(4-aminoanilino)acetamide
PubChem CID19048353
Molecular FormulaC8H11N3O
Molecular Weight165.20 g/mol
Exact Mass165.09
IUPAC Name2-(4-aminoanilino)acetamide
SMILESNC(=O)CNc1ccc(N)cc1
InChIInChI=1S/C8H11N3O/c9-6-1-3-7(4-2-6)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12)
InChIKeySUVDKDKSNYZGFY-UHFFFAOYSA-N
XLogP0.17
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.20
LogP ≤ 50.17
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_no_alk(40)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

2-(4-chloroanilino)acetamide
CID 22320740
1-(4-aminoanilino)-3-hydroxypropan-2-one
CID 91371398
4-N-(2-aminoprop-2-enyl)benzene-1,4-diamine
CID 70185989
1-(4-aminoanilino)-3-(dimethylamino)propan-2-one
CID 91173512
2-[4-(2-methylpropyl)anilino]acetamide
CID 96671110
2-(4-cyclopentyloxyanilino)acetamide
CID 70088108
2-(4-pyrrolidin-1-ylanilino)acetamide
CID 60674358
1-amino-4-[[2-oxo-2-(sulfinatoamino)ethyl]amino]benzene
CID 89148865
2-(3,4-dimethylanilino)acetamide
CID 28580413
1-(4-aminoanilino)-5-(dimethylamino)pentan-2-one
CID 90793458
5-[(2-amino-2-oxoethyl)amino]pyridine-2-carboxylic acid
CID 104638701
2-(4-cyclopentylsulfanylanilino)acetamide
CID 96676524

Frequently Asked Questions

What is the IUPAC name of 2-(4-aminoanilino)acetamide?
The IUPAC name of 2-(4-aminoanilino)acetamide (CID 19048353) is 2-(4-aminoanilino)acetamide.
What is the SMILES notation for 2-(4-aminoanilino)acetamide?
The canonical SMILES for 2-(4-aminoanilino)acetamide is NC(=O)CNc1ccc(N)cc1.
What is the InChIKey of 2-(4-aminoanilino)acetamide?
The InChIKey is SUVDKDKSNYZGFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11N3O/c9-6-1-3-7(4-2-6)11-5-8(10)12/h1-4,11H,5,9H2,(H2,10,12).
What are the key properties of 2-(4-aminoanilino)acetamide?
2-(4-aminoanilino)acetamide has a molecular weight of 165.20 g/mol, XLogP of 0.17, 3 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-aminoanilino)acetamide is sourced from PubChem (CID 19048353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).