N-cyclopentyl-2-ethenyl-3-methylbenzamide

C15H19NO — CID 169452439

IUPACN-cyclopentyl-2-ethenyl-3-methylbenzamide
SMILESC=Cc1c(C)cccc1C(=O)NC1CCCC1
InChIInChI=1S/C15H19NO/c1-3-13-11(2)7-6-10-14(13)15(17)16-12-8-4-5-9-12/h3,6-7,10,12H,1,4-5,8-9H2,2H3,(H,16,17)
InChIKeyDHZXUYLXJNQNMW-UHFFFAOYSA-N
MW229.32 g/mol
LogP3.31
Rot. Bonds3

About N-cyclopentyl-2-ethenyl-3-methylbenzamide

N-cyclopentyl-2-ethenyl-3-methylbenzamide (PubChem CID 169452439) has the molecular formula C15H19NO and a molecular weight of 229.32 g/mol. Its IUPAC name is N-cyclopentyl-2-ethenyl-3-methylbenzamide.

Molecular Properties

Compound NameN-cyclopentyl-2-ethenyl-3-methylbenzamide
PubChem CID169452439
Molecular FormulaC15H19NO
Molecular Weight229.32 g/mol
Exact Mass229.15
IUPAC NameN-cyclopentyl-2-ethenyl-3-methylbenzamide
SMILESC=Cc1c(C)cccc1C(=O)NC1CCCC1
InChIInChI=1S/C15H19NO/c1-3-13-11(2)7-6-10-14(13)15(17)16-12-8-4-5-9-12/h3,6-7,10,12H,1,4-5,8-9H2,2H3,(H,16,17)
InChIKeyDHZXUYLXJNQNMW-UHFFFAOYSA-N
XLogP3.31
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-cyclopropyl-2-ethenyl-3-methylbenzamide
CID 169452426
2-ethenyl-3-methyl-N-(oxan-4-yl)benzamide
CID 169452441
N-cycloheptyl-2-fluoro-3-methylbenzamide
CID 80719060
2-ethenyl-3-methyl-N-propan-2-ylbenzamide
CID 169452425
N-cyclobutyl-2-hydroxy-3-methylbenzamide
CID 62416564
N-cyclobutyl-2-fluoro-3-methylbenzamide
CID 80712137
2-amino-N-cyclobutyl-3-methylbenzamide
CID 62416482
N-cyclopentyl-3-hydroxy-2-methylbenzamide
CID 82786265
N-cyclopentyl-3-methyl-2-nitrobenzamide
CID 890353
N-cyclohexyl-2-methylpyridine-3-carboxamide
CID 78951017
N-cyclopropyl-2-methylbenzamide;hydrochloride
CID 162767207
N-cyclohexyl-2,5-dimethylbenzamide
CID 925443

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-ethenyl-3-methylbenzamide?
The IUPAC name of N-cyclopentyl-2-ethenyl-3-methylbenzamide (CID 169452439) is N-cyclopentyl-2-ethenyl-3-methylbenzamide.
What is the SMILES notation for N-cyclopentyl-2-ethenyl-3-methylbenzamide?
The canonical SMILES for N-cyclopentyl-2-ethenyl-3-methylbenzamide is C=Cc1c(C)cccc1C(=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-ethenyl-3-methylbenzamide?
The InChIKey is DHZXUYLXJNQNMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO/c1-3-13-11(2)7-6-10-14(13)15(17)16-12-8-4-5-9-12/h3,6-7,10,12H,1,4-5,8-9H2,2H3,(H,16,17).
What are the key properties of N-cyclopentyl-2-ethenyl-3-methylbenzamide?
N-cyclopentyl-2-ethenyl-3-methylbenzamide has a molecular weight of 229.32 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-ethenyl-3-methylbenzamide is sourced from PubChem (CID 169452439), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).