N-(1-cyanocyclopentyl)propanamide

C9H14N2O — CID 55029198

IUPACN-(1-cyanocyclopentyl)propanamide
SMILESCCC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C9H14N2O/c1-2-8(12)11-9(7-10)5-3-4-6-9/h2-6H2,1H3,(H,11,12)
InChIKeyMTGNGSDETJUNOA-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.35
Rot. Bonds2

About N-(1-cyanocyclopentyl)propanamide

N-(1-cyanocyclopentyl)propanamide (PubChem CID 55029198) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)propanamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)propanamide
PubChem CID55029198
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC NameN-(1-cyanocyclopentyl)propanamide
SMILESCCC(=O)NC1(C#N)CCCC1
InChIInChI=1S/C9H14N2O/c1-2-8(12)11-9(7-10)5-3-4-6-9/h2-6H2,1H3,(H,11,12)
InChIKeyMTGNGSDETJUNOA-UHFFFAOYSA-N
XLogP1.35
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyanocyclopentyl)-2-methoxyacetamide
CID 60724698
N-(1-cyanocyclopentyl)-3,3-dimethylbutanamide
CID 55029199
N-(1-cyanocyclooctyl)hexanamide
CID 54904747
N-(1-cyanocyclohexyl)-2-[ethyl(methyl)amino]acetamide
CID 60516717
2-bromo-N-(1-cyanocycloheptyl)acetamide
CID 63680243
N-(1-cyanocyclooctyl)-3,3-dimethylbutanamide
CID 54904649
N-(1-cyanocyclooctyl)octanamide
CID 60968683
N-(1-cyanocyclopentyl)-2-(1-hydroxycyclopentyl)acetamide
CID 111538101
N-(1-cyanocyclooctyl)-3-methylsulfanylpropanamide
CID 60968545
N-(1-cyanocyclopentyl)-2-(2-hydroxyethylsulfanyl)acetamide
CID 43392467
N-(1-cyanocyclopentyl)-2-(4-ethylpiperazin-1-yl)acetamide
CID 78787236
N-(1-cyanocycloheptyl)-3-ethoxypropanamide
CID 62591017

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)propanamide?
The IUPAC name of N-(1-cyanocyclopentyl)propanamide (CID 55029198) is N-(1-cyanocyclopentyl)propanamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)propanamide?
The canonical SMILES for N-(1-cyanocyclopentyl)propanamide is CCC(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)propanamide?
The InChIKey is MTGNGSDETJUNOA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-2-8(12)11-9(7-10)5-3-4-6-9/h2-6H2,1H3,(H,11,12).
What are the key properties of N-(1-cyanocyclopentyl)propanamide?
N-(1-cyanocyclopentyl)propanamide has a molecular weight of 166.22 g/mol, XLogP of 1.35, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)propanamide is sourced from PubChem (CID 55029198), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).