2-amino-N-cyclobutyl-N-methylbenzamide

C12H16N2O — CID 115747527

IUPAC2-amino-N-cyclobutyl-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1N)C1CCC1
InChIInChI=1S/C12H16N2O/c1-14(9-5-4-6-9)12(15)10-7-2-3-8-11(10)13/h2-3,7-9H,4-6,13H2,1H3
InChIKeyICNGWCSNCUMHSW-UHFFFAOYSA-N
MW204.27 g/mol
LogP1.89
Rot. Bonds2

About 2-amino-N-cyclobutyl-N-methylbenzamide

2-amino-N-cyclobutyl-N-methylbenzamide (PubChem CID 115747527) has the molecular formula C12H16N2O and a molecular weight of 204.27 g/mol. Its IUPAC name is 2-amino-N-cyclobutyl-N-methylbenzamide.

Molecular Properties

Compound Name2-amino-N-cyclobutyl-N-methylbenzamide
PubChem CID115747527
Molecular FormulaC12H16N2O
Molecular Weight204.27 g/mol
Exact Mass204.13
IUPAC Name2-amino-N-cyclobutyl-N-methylbenzamide
SMILESCN(C(=O)c1ccccc1N)C1CCC1
InChIInChI=1S/C12H16N2O/c1-14(9-5-4-6-9)12(15)10-7-2-3-8-11(10)13/h2-3,7-9H,4-6,13H2,1H3
InChIKeyICNGWCSNCUMHSW-UHFFFAOYSA-N
XLogP1.89
TPSA46.33 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.27
LogP ≤ 51.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

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2-amino-N-methyl-N-(oxolan-3-yl)benzamide;hydrochloride
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2-amino-N-methyl-N-(1-phenylpiperidin-3-yl)benzamide
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2-bromo-N-cycloheptyl-N-methylbenzamide
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2-amino-N-cyclopentyl-N,5-dimethylbenzamide
CID 62509333
2-[cyclohexyl(methyl)carbamoyl]benzoate
CID 2302400
2-amino-N-cyclohexyl-4-fluoro-N-methylbenzamide
CID 62072600
2-amino-4-bromo-N-cyclopropyl-N-methylbenzamide
CID 79714357
2-amino-5-chloro-N-cyclohexyl-N-methylbenzamide
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Frequently Asked Questions

What is the IUPAC name of 2-amino-N-cyclobutyl-N-methylbenzamide?
The IUPAC name of 2-amino-N-cyclobutyl-N-methylbenzamide (CID 115747527) is 2-amino-N-cyclobutyl-N-methylbenzamide.
What is the SMILES notation for 2-amino-N-cyclobutyl-N-methylbenzamide?
The canonical SMILES for 2-amino-N-cyclobutyl-N-methylbenzamide is CN(C(=O)c1ccccc1N)C1CCC1.
What is the InChIKey of 2-amino-N-cyclobutyl-N-methylbenzamide?
The InChIKey is ICNGWCSNCUMHSW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2O/c1-14(9-5-4-6-9)12(15)10-7-2-3-8-11(10)13/h2-3,7-9H,4-6,13H2,1H3.
What are the key properties of 2-amino-N-cyclobutyl-N-methylbenzamide?
2-amino-N-cyclobutyl-N-methylbenzamide has a molecular weight of 204.27 g/mol, XLogP of 1.89, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-cyclobutyl-N-methylbenzamide is sourced from PubChem (CID 115747527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).