N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide

C15H19N3O — CID 60704670

IUPACN-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)NC2(C#N)CCCC2)cc1
InChIInChI=1S/C15H19N3O/c1-18(2)13-7-5-12(6-8-13)14(19)17-15(11-16)9-3-4-10-15/h5-8H,3-4,9-10H2,1-2H3,(H,17,19)
InChIKeyDGUNTMLXLQWRSD-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.32
Rot. Bonds3

About N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide

N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide (PubChem CID 60704670) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide
PubChem CID60704670
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide
SMILESCN(C)c1ccc(C(=O)NC2(C#N)CCCC2)cc1
InChIInChI=1S/C15H19N3O/c1-18(2)13-7-5-12(6-8-13)14(19)17-15(11-16)9-3-4-10-15/h5-8H,3-4,9-10H2,1-2H3,(H,17,19)
InChIKeyDGUNTMLXLQWRSD-UHFFFAOYSA-N
XLogP2.32
TPSA56.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-cyanocycloheptyl)-4-(dimethylamino)benzamide
CID 60966830
N-(1-cyanocyclohexyl)-4-hydroxybenzamide
CID 60717123
N-(1-cyanocyclopentyl)-4-fluorobenzamide
CID 60660161
N-(1-cyanocyclopentyl)-4-methylsulfonylbenzamide
CID 60665986
N-(1-cyanocyclobutyl)-4-iodobenzamide
CID 55137573
N-[1-(chloromethyl)cyclopentyl]-4-(dimethylamino)benzamide
CID 113272407
N-(1-cyanocyclohexyl)-3-hydroxy-4-methylbenzamide
CID 60718518
6-chloro-N-(1-cyanocycloheptyl)pyridine-3-carboxamide
CID 60967531
N-(1-cyanocyclopentyl)-4-[5-(4-methylphenyl)-1,3,4-oxadiazol-2-yl]benzamide
CID 78830320
N-(1-cyanocycloheptyl)-3,5-dihydroxybenzamide
CID 104938860
N-(1-cyanocyclohexyl)pyridazine-4-carboxamide
CID 112705399
N-(1-cyanocycloheptyl)thiophene-3-carboxamide
CID 54904351

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide?
The IUPAC name of N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide (CID 60704670) is N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide is CN(C)c1ccc(C(=O)NC2(C#N)CCCC2)cc1.
What is the InChIKey of N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide?
The InChIKey is DGUNTMLXLQWRSD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-18(2)13-7-5-12(6-8-13)14(19)17-15(11-16)9-3-4-10-15/h5-8H,3-4,9-10H2,1-2H3,(H,17,19).
What are the key properties of N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide?
N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide has a molecular weight of 257.34 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-4-(dimethylamino)benzamide is sourced from PubChem (CID 60704670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).