3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide

C11H19N3O — CID 64679356

IUPAC3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide
SMILESCC(C)(N)CC(=O)NC1CCCC1C#N
InChIInChI=1S/C11H19N3O/c1-11(2,13)6-10(15)14-9-5-3-4-8(9)7-12/h8-9H,3-6,13H2,1-2H3,(H,14,15)
InChIKeyHNQUOBDFUUQHTA-UHFFFAOYSA-N
MW209.29 g/mol
LogP0.92
Rot. Bonds3

About 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide

3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide (PubChem CID 64679356) has the molecular formula C11H19N3O and a molecular weight of 209.29 g/mol. Its IUPAC name is 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide.

Molecular Properties

Compound Name3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide
PubChem CID64679356
Molecular FormulaC11H19N3O
Molecular Weight209.29 g/mol
Exact Mass209.15
IUPAC Name3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide
SMILESCC(C)(N)CC(=O)NC1CCCC1C#N
InChIInChI=1S/C11H19N3O/c1-11(2,13)6-10(15)14-9-5-3-4-8(9)7-12/h8-9H,3-6,13H2,1-2H3,(H,14,15)
InChIKeyHNQUOBDFUUQHTA-UHFFFAOYSA-N
XLogP0.92
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 50.92
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

6-amino-N-(2-cyanocyclopentyl)-4,4-dimethylhexanamide
CID 65291034
3-amino-N-(2-hydroxycyclohexyl)-3-methylbutanamide
CID 64677641
N-(2-cyanocyclopentyl)-2-cyclopentylacetamide
CID 62961621
N-(2-cyanocyclopentyl)-4-(methylamino)butanamide
CID 62961468
5-[(2-cyanocyclopentyl)amino]-3-methyl-5-oxopentanoic acid
CID 62961989
2-(4-aminopiperidin-1-yl)-N-(2-cyanocyclopentyl)acetamide
CID 79327886
N-[(1S,2S)-2-cyanocyclopentyl]-2,2,3,3-tetramethylcyclopropane-1-carboxamide
CID 97121023
[(1R,2R)-2-cyanocyclohexyl]carbamic acid
CID 89240043
N-(2-cyanocyclopentyl)-2-(2-hydroxyphenyl)acetamide
CID 79602744
2-bromo-N-(2-cyanocyclopentyl)butanamide
CID 62962905
N-(2-cyanocyclopentyl)cyclooctanecarboxamide
CID 65018663
N-(2-cyanocyclopentyl)-3-phenylpropanamide
CID 62961970

Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide?
The IUPAC name of 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide (CID 64679356) is 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide.
What is the SMILES notation for 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide?
The canonical SMILES for 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide is CC(C)(N)CC(=O)NC1CCCC1C#N.
What is the InChIKey of 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide?
The InChIKey is HNQUOBDFUUQHTA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3O/c1-11(2,13)6-10(15)14-9-5-3-4-8(9)7-12/h8-9H,3-6,13H2,1-2H3,(H,14,15).
What are the key properties of 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide?
3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide has a molecular weight of 209.29 g/mol, XLogP of 0.92, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-cyanocyclopentyl)-3-methylbutanamide is sourced from PubChem (CID 64679356), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).