N-(3-aminophenyl)acetamide

C8H10N2O — CID 7604

IUPACN-(3-aminophenyl)acetamide
SMILESCC(=O)Nc1cccc(N)c1
InChIInChI=1S/C8H10N2O/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,9H2,1H3,(H,10,11)
InChIKeyPEMGGJDINLGTON-UHFFFAOYSA-N
MW150.18 g/mol
LogP1.23
Rot. Bonds1

About N-(3-aminophenyl)acetamide

N-(3-aminophenyl)acetamide (PubChem CID 7604) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is N-(3-aminophenyl)acetamide.

Molecular Properties

Compound NameN-(3-aminophenyl)acetamide
PubChem CID7604
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC NameN-(3-aminophenyl)acetamide
SMILESCC(=O)Nc1cccc(N)c1
InChIInChI=1S/C8H10N2O/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,9H2,1H3,(H,10,11)
InChIKeyPEMGGJDINLGTON-UHFFFAOYSA-N
XLogP1.23
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 51.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

Acetanilide
CID 904
N-(3-Methylphenyl)acetamide
CID 10843
2-Methylacetanilide
CID 12107
4-Methylacetanilide
CID 7684
N-acetyl-o-toluidine
CID 8443
4-(N-Propionylaniline)piperidine
CID 259381
Chloroacetanilide
CID 11485
Acetoacetanilide
CID 7592
4-Aminoacetanilide
CID 31230
Arsacetin
CID 95019
Amphenidone
CID 8641
4-Nitroacetanilide
CID 7691

Frequently Asked Questions

What is the IUPAC name of N-(3-aminophenyl)acetamide?
The IUPAC name of N-(3-aminophenyl)acetamide (CID 7604) is N-(3-aminophenyl)acetamide.
What is the SMILES notation for N-(3-aminophenyl)acetamide?
The canonical SMILES for N-(3-aminophenyl)acetamide is CC(=O)Nc1cccc(N)c1.
What is the InChIKey of N-(3-aminophenyl)acetamide?
The InChIKey is PEMGGJDINLGTON-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-6(11)10-8-4-2-3-7(9)5-8/h2-5H,9H2,1H3,(H,10,11).
What are the key properties of N-(3-aminophenyl)acetamide?
N-(3-aminophenyl)acetamide has a molecular weight of 150.18 g/mol, XLogP of 1.23, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-aminophenyl)acetamide is sourced from PubChem (CID 7604), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).