N-cyclobutyl-4-methylbenzamide

C12H15NO — CID 23530676

IUPACN-cyclobutyl-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCC2)cc1
InChIInChI=1S/C12H15NO/c1-9-5-7-10(8-6-9)12(14)13-11-3-2-4-11/h5-8,11H,2-4H2,1H3,(H,13,14)
InChIKeyCIBFHOIIYMYQRS-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.28
Rot. Bonds2

About N-cyclobutyl-4-methylbenzamide

N-cyclobutyl-4-methylbenzamide (PubChem CID 23530676) has the molecular formula C12H15NO and a molecular weight of 189.26 g/mol. Its IUPAC name is N-cyclobutyl-4-methylbenzamide.

Molecular Properties

Compound NameN-cyclobutyl-4-methylbenzamide
PubChem CID23530676
Molecular FormulaC12H15NO
Molecular Weight189.26 g/mol
Exact Mass189.12
IUPAC NameN-cyclobutyl-4-methylbenzamide
SMILESCc1ccc(C(=O)NC2CCC2)cc1
InChIInChI=1S/C12H15NO/c1-9-5-7-10(8-6-9)12(14)13-11-3-2-4-11/h5-8,11H,2-4H2,1H3,(H,13,14)
InChIKeyCIBFHOIIYMYQRS-UHFFFAOYSA-N
XLogP2.28
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclooctyl-4-methylbenzamide
CID 3995245
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CID 171081015
N-(1-iodopiperidin-4-yl)-4-methylbenzamide
CID 148698295
4-methyl-N-[(1R,5S)-9-methyl-9-azabicyclo[3.3.1]nonan-3-yl]benzamide
CID 139083931
N-cyclobutyl-3,4-dimethylbenzamide;ethane
CID 142916267
N-(cyclohexylcarbamothioyl)-4-methylbenzamide
CID 923682
N-cyclopentyl-3-[(4-methylbenzoyl)amino]benzamide
CID 2221852
4-methyl-N-(1-propan-2-ylpiperidin-4-yl)benzamide
CID 25236563
N-[2-(cyclopentylamino)-2-oxoethyl]-4-methylbenzamide
CID 1262280
N-(3-methylcyclohexyl)-4-[4-[(3-methylcyclohexyl)carbamoyl]phenyl]benzamide
CID 66710031
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CID 145473701

Frequently Asked Questions

What is the IUPAC name of N-cyclobutyl-4-methylbenzamide?
The IUPAC name of N-cyclobutyl-4-methylbenzamide (CID 23530676) is N-cyclobutyl-4-methylbenzamide.
What is the SMILES notation for N-cyclobutyl-4-methylbenzamide?
The canonical SMILES for N-cyclobutyl-4-methylbenzamide is Cc1ccc(C(=O)NC2CCC2)cc1.
What is the InChIKey of N-cyclobutyl-4-methylbenzamide?
The InChIKey is CIBFHOIIYMYQRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15NO/c1-9-5-7-10(8-6-9)12(14)13-11-3-2-4-11/h5-8,11H,2-4H2,1H3,(H,13,14).
What are the key properties of N-cyclobutyl-4-methylbenzamide?
N-cyclobutyl-4-methylbenzamide has a molecular weight of 189.26 g/mol, XLogP of 2.28, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclobutyl-4-methylbenzamide is sourced from PubChem (CID 23530676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).