4-cyclobutyl-N-propan-2-ylbenzamide

C14H19NO — CID 174282086

IUPAC4-cyclobutyl-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H19NO/c1-10(2)15-14(16)13-8-6-12(7-9-13)11-4-3-5-11/h6-11H,3-5H2,1-2H3,(H,15,16)
InChIKeyUZCITHZBXZPKIQ-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.09
Rot. Bonds3

About 4-cyclobutyl-N-propan-2-ylbenzamide

4-cyclobutyl-N-propan-2-ylbenzamide (PubChem CID 174282086) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 4-cyclobutyl-N-propan-2-ylbenzamide.

Molecular Properties

Compound Name4-cyclobutyl-N-propan-2-ylbenzamide
PubChem CID174282086
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name4-cyclobutyl-N-propan-2-ylbenzamide
SMILESCC(C)NC(=O)c1ccc(C2CCC2)cc1
InChIInChI=1S/C14H19NO/c1-10(2)15-14(16)13-8-6-12(7-9-13)11-4-3-5-11/h6-11H,3-5H2,1-2H3,(H,15,16)
InChIKeyUZCITHZBXZPKIQ-UHFFFAOYSA-N
XLogP3.09
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.09
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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2-(4-cyclohexylphenyl)-2-oxo-N-propan-2-ylacetamide
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(E)-2-[(4-cyclobutylbenzoyl)amino]hex-4-enoic acid
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4-cyclohexyl-N'-methylbenzohydrazide
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1-(4-cyclobutylphenyl)-2-propan-2-yloxyethanone
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N-[(2S)-1-(benzylamino)-1-oxopropan-2-yl]-4-cyclohexylbenzamide
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N-[(2S)-1-(6-azaspiro[2.5]octan-6-yl)-1-oxopropan-2-yl]-4-cyclopropylbenzamide
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1-(4-cyclobutylphenyl)-2-methylbutan-1-one
CID 116505591
methyl 2-[(4-cyclopentylbenzoyl)amino]acetate
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N-(3-amino-2-methylpropyl)-4-cyclohexylbenzamide
CID 119995934

Frequently Asked Questions

What is the IUPAC name of 4-cyclobutyl-N-propan-2-ylbenzamide?
The IUPAC name of 4-cyclobutyl-N-propan-2-ylbenzamide (CID 174282086) is 4-cyclobutyl-N-propan-2-ylbenzamide.
What is the SMILES notation for 4-cyclobutyl-N-propan-2-ylbenzamide?
The canonical SMILES for 4-cyclobutyl-N-propan-2-ylbenzamide is CC(C)NC(=O)c1ccc(C2CCC2)cc1.
What is the InChIKey of 4-cyclobutyl-N-propan-2-ylbenzamide?
The InChIKey is UZCITHZBXZPKIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-10(2)15-14(16)13-8-6-12(7-9-13)11-4-3-5-11/h6-11H,3-5H2,1-2H3,(H,15,16).
What are the key properties of 4-cyclobutyl-N-propan-2-ylbenzamide?
4-cyclobutyl-N-propan-2-ylbenzamide has a molecular weight of 217.31 g/mol, XLogP of 3.09, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclobutyl-N-propan-2-ylbenzamide is sourced from PubChem (CID 174282086), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).