N-(1-cyanocyclopentyl)-2-methylpropanamide

C10H16N2O — CID 50986529

IUPACN-(1-cyanocyclopentyl)-2-methylpropanamide
SMILESCC(C)C(=O)NC1(C#N)CCCC1
InChIInChI=1S/C10H16N2O/c1-8(2)9(13)12-10(7-11)5-3-4-6-10/h8H,3-6H2,1-2H3,(H,12,13)
InChIKeyMFERAZUCTFXDRO-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.59
Rot. Bonds2

About N-(1-cyanocyclopentyl)-2-methylpropanamide

N-(1-cyanocyclopentyl)-2-methylpropanamide (PubChem CID 50986529) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is N-(1-cyanocyclopentyl)-2-methylpropanamide.

Molecular Properties

Compound NameN-(1-cyanocyclopentyl)-2-methylpropanamide
PubChem CID50986529
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC NameN-(1-cyanocyclopentyl)-2-methylpropanamide
SMILESCC(C)C(=O)NC1(C#N)CCCC1
InChIInChI=1S/C10H16N2O/c1-8(2)9(13)12-10(7-11)5-3-4-6-10/h8H,3-6H2,1-2H3,(H,12,13)
InChIKeyMFERAZUCTFXDRO-UHFFFAOYSA-N
XLogP1.59
TPSA52.89 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

Acetamide, N-(1-cyanocyclopentyl)-
CID 199802
N-(1-Cyanocyclopentyl)pentanamide
CID 11790092
N-[3-(2-cyanopropan-2-yl)-1-methylcyclopentyl]acetamide
CID 4020432
N-(1-cyanocyclopentyl)-3,3,3-trifluoropropanamide
CID 60731314
N-(1-cyanocyclopentyl)-3,3,3-trifluoro-2-(trifluoromethyl)propanamide
CID 103309833
N-(3-cyanopentan-3-yl)-3,3-difluorocyclopentane-1-carboxamide
CID 114100750
N-(1-cyanocyclopentyl)-2,2-difluoropropanamide
CID 131036045
N-(1-cyanocyclohexyl)propanamide
CID 22972528
N-(1-cyanocyclopentyl)propanamide
CID 55029198
2-cyano-N-(3-methylhexan-3-yl)acetamide
CID 60052057
N-(1-cyanocyclohexyl)-2-methylpentanamide
CID 60704678
N-(1-cyanocyclopentyl)-2-methylpentanamide
CID 60704780

Frequently Asked Questions

What is the IUPAC name of N-(1-cyanocyclopentyl)-2-methylpropanamide?
The IUPAC name of N-(1-cyanocyclopentyl)-2-methylpropanamide (CID 50986529) is N-(1-cyanocyclopentyl)-2-methylpropanamide.
What is the SMILES notation for N-(1-cyanocyclopentyl)-2-methylpropanamide?
The canonical SMILES for N-(1-cyanocyclopentyl)-2-methylpropanamide is CC(C)C(=O)NC1(C#N)CCCC1.
What is the InChIKey of N-(1-cyanocyclopentyl)-2-methylpropanamide?
The InChIKey is MFERAZUCTFXDRO-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8(2)9(13)12-10(7-11)5-3-4-6-10/h8H,3-6H2,1-2H3,(H,12,13).
What are the key properties of N-(1-cyanocyclopentyl)-2-methylpropanamide?
N-(1-cyanocyclopentyl)-2-methylpropanamide has a molecular weight of 180.25 g/mol, XLogP of 1.59, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-cyanocyclopentyl)-2-methylpropanamide is sourced from PubChem (CID 50986529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).