N-(1-cyanocyclopentyl)-N-methylacetamide

C9H14N2O — CID 82125090

IUPACN-(1-cyanocyclopentyl)-N-methylacetamide
SMILESCC(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C9H14N2O/c1-8(12)11(2)9(7-10)5-3-4-6-9/h3-6H2,1-2H3
InChIKeySIQJSZNGRPWXJE-UHFFFAOYSA-N
MW166.22 g/mol
LogP1.30
Rot. Bonds1

About N-(1-cyanocyclopentyl)-N-methylacetamide

N-(1-cyanocyclopentyl)-N-methylacetamide (PubChem CID 82125090) has the molecular formula C9H14N2O and a molecular weight of 166.22 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-N-methylacetamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-N-methylacetamide
PubChem CID82125090
Molecular FormulaC9H14N2O
Molecular Weight166.22 g/mol
Exact Mass166.11
IUPAC NameN-(1-cyanocyclopentyl)-N-methylacetamide
SMILESCC(=O)N(C)C1(C#N)CCCC1
InChIInChI=1S/C9H14N2O/c1-8(12)11(2)9(7-10)5-3-4-6-9/h3-6H2,1-2H3
InChIKeySIQJSZNGRPWXJE-UHFFFAOYSA-N
XLogP1.30
TPSA44.10 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500166.22
LogP ≤ 51.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-(1-cyanocyclopentyl)-N-methylcyclohexanecarboxamide
CID 82129288
(2R)-2-chloro-N-(1-cyanocyclohexyl)-N-methylpropanamide
CID 7131211
1-(dimethylamino)cyclooctane-1-carbonitrile
CID 43802603
N-(1-cyanocyclohexyl)-2-(2-hydroxyethylsulfanyl)-N-methylacetamide
CID 43393702
2-[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]sulfanylacetic acid
CID 43091446
N-(1-cyanocyclopentyl)-4-fluoro-N-methylbenzamide
CID 82130674
2-(3-aminoazetidin-1-yl)-N-(1-cyanocyclohexyl)-N-methylacetamide
CID 65249965
2,6-dichloro-N-(1-cyanocyclohexyl)-N-methylpyridine-4-carboxamide
CID 61215479
5-chloro-N-(1-cyanocyclohexyl)-N-methylpyrazine-2-carboxamide
CID 107371975
2-[2-[(1-cyanocyclohexyl)-methylamino]-2-oxoethyl]sulfanyl-3-methylbutanoic acid
CID 105353702
N-(1-cyanocyclohexyl)-N-methyl-2-[4-(2-oxo-2-piperidin-1-ylethyl)piperazin-1-yl]acetamide
CID 55462141
N-(1-cyanocyclohexyl)-2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-methylacetamide
CID 78962673

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-N-methylacetamide?
The IUPAC name of N-(1-cyanocyclopentyl)-N-methylacetamide (CID 82125090) is N-(1-cyanocyclopentyl)-N-methylacetamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-N-methylacetamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-N-methylacetamide is CC(=O)N(C)C1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-N-methylacetamide?
The InChIKey is SIQJSZNGRPWXJE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H14N2O/c1-8(12)11(2)9(7-10)5-3-4-6-9/h3-6H2,1-2H3.
What are the key properties of N-(1-cyanocyclopentyl)-N-methylacetamide?
N-(1-cyanocyclopentyl)-N-methylacetamide has a molecular weight of 166.22 g/mol, XLogP of 1.30, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-N-methylacetamide is sourced from PubChem (CID 82125090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).