2-amino-1-[2-(cyclopropylamino)phenyl]ethanone

C11H14N2O — CID 83817941

IUPAC2-amino-1-[2-(cyclopropylamino)phenyl]ethanone
SMILESNCC(=O)c1ccccc1NC1CC1
InChIInChI=1S/C11H14N2O/c12-7-11(14)9-3-1-2-4-10(9)13-8-5-6-8/h1-4,8,13H,5-7,12H2
InChIKeyFNYUVDGGPHXAGO-UHFFFAOYSA-N
MW190.25 g/mol
LogP1.40
Rot. Bonds4

About 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone

2-amino-1-[2-(cyclopropylamino)phenyl]ethanone (PubChem CID 83817941) has the molecular formula C11H14N2O and a molecular weight of 190.25 g/mol. Its IUPAC name is 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone.

Molecular Properties

Compound Name2-amino-1-[2-(cyclopropylamino)phenyl]ethanone
PubChem CID83817941
Molecular FormulaC11H14N2O
Molecular Weight190.25 g/mol
Exact Mass190.11
IUPAC Name2-amino-1-[2-(cyclopropylamino)phenyl]ethanone
SMILESNCC(=O)c1ccccc1NC1CC1
InChIInChI=1S/C11H14N2O/c12-7-11(14)9-3-1-2-4-10(9)13-8-5-6-8/h1-4,8,13H,5-7,12H2
InChIKeyFNYUVDGGPHXAGO-UHFFFAOYSA-N
XLogP1.40
TPSA55.12 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.25
LogP ≤ 51.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone 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-(cyclopropylamino)benzamide
CID 119089293
ethyl 2-(cyclopropylamino)benzoate
CID 103438878
methyl 2-(cyclopropylamino)benzoate
CID 83697867
2-[[4-(2-methylbutan-2-yl)cyclohexyl]amino]benzoic acid
CID 43322139
ethyl 4-(2-benzoylanilino)piperidine-1-carboxylate
CID 13450696
2-(2-aminoethyl)-N-cyclopropylaniline
CID 83816645
methyl 2-[(4-methylcycloheptyl)amino]benzoate
CID 65081177
2-[(3-aminocyclopentyl)amino]-N,N-dimethylbenzamide
CID 79462007
2-[(3-phenylcyclobutyl)amino]benzoic acid
CID 43632305
ethyl 2-[(8-methyl-8-azabicyclo[3.2.1]octan-3-yl)amino]benzoate
CID 43322154
ethyl 2-[(3-propan-2-ylcyclobutyl)amino]benzoate
CID 103561022
methyl 2-[(1-methylpiperidin-4-yl)amino]benzoate
CID 43139508

Frequently Asked Questions

What is the IUPAC name of 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone?
The IUPAC name of 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone (CID 83817941) is 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone.
What is the SMILES notation for 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone?
The canonical SMILES for 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone is NCC(=O)c1ccccc1NC1CC1.
What is the InChIKey of 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone?
The InChIKey is FNYUVDGGPHXAGO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H14N2O/c12-7-11(14)9-3-1-2-4-10(9)13-8-5-6-8/h1-4,8,13H,5-7,12H2.
What are the key properties of 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone?
2-amino-1-[2-(cyclopropylamino)phenyl]ethanone has a molecular weight of 190.25 g/mol, XLogP of 1.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-1-[2-(cyclopropylamino)phenyl]ethanone is sourced from PubChem (CID 83817941), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).