2-amino-5-cyano-N,3-dimethylpentanamide

C8H15N3O — CID 174428654

IUPAC2-amino-5-cyano-N,3-dimethylpentanamide
SMILESCNC(=O)C(N)C(C)CCC#N
InChIInChI=1S/C8H15N3O/c1-6(4-3-5-9)7(10)8(12)11-2/h6-7H,3-4,10H2,1-2H3,(H,11,12)
InChIKeyYNPUZZJIZRXIIL-UHFFFAOYSA-N
MW169.23 g/mol
LogP-0.00
Rot. Bonds4

About 2-amino-5-cyano-N,3-dimethylpentanamide

2-amino-5-cyano-N,3-dimethylpentanamide (PubChem CID 174428654) has the molecular formula C8H15N3O and a molecular weight of 169.23 g/mol. Its IUPAC name is 2-amino-5-cyano-N,3-dimethylpentanamide.

Molecular Properties

Compound Name2-amino-5-cyano-N,3-dimethylpentanamide
PubChem CID174428654
Molecular FormulaC8H15N3O
Molecular Weight169.23 g/mol
Exact Mass169.12
IUPAC Name2-amino-5-cyano-N,3-dimethylpentanamide
SMILESCNC(=O)C(N)C(C)CCC#N
InChIInChI=1S/C8H15N3O/c1-6(4-3-5-9)7(10)8(12)11-2/h6-7H,3-4,10H2,1-2H3,(H,11,12)
InChIKeyYNPUZZJIZRXIIL-UHFFFAOYSA-N
XLogP-0.00
TPSA78.91 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.23
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-hydroxy-4-methylhexanenitrile
CID 130122658
dimethyl 2-(4-cyanobutan-2-yl)butanedioate
CID 122220914
2-amino-N-(3-cyanopropyl)propanamide
CID 62666254
2-amino-3-hydroxy-N-methylbutanamide;ethane
CID 155713767
methyl (2S)-2-amino-5-cyanopentanoate;hydrochloride
CID 139906504
4-methyl-5-oxohexanenitrile
CID 11564477
2-amino-N-(cyanomethyl)-3-methylbutanamide
CID 61253488
2-amino-N-(2-cyanoethyl)-4-methylpentanamide
CID 43364126
6-cyano-4-methylhexanamide
CID 87903617
(2S)-N-(2-cyanoethyl)-2-(methylamino)propanamide
CID 94522697
2-amino-N,5-dimethylhexanamide
CID 116850475
ethyl N-(5-cyanopentan-2-yl)carbamate
CID 45120210

Frequently Asked Questions

What is the IUPAC name of 2-amino-5-cyano-N,3-dimethylpentanamide?
The IUPAC name of 2-amino-5-cyano-N,3-dimethylpentanamide (CID 174428654) is 2-amino-5-cyano-N,3-dimethylpentanamide.
What is the SMILES notation for 2-amino-5-cyano-N,3-dimethylpentanamide?
The canonical SMILES for 2-amino-5-cyano-N,3-dimethylpentanamide is CNC(=O)C(N)C(C)CCC#N.
What is the InChIKey of 2-amino-5-cyano-N,3-dimethylpentanamide?
The InChIKey is YNPUZZJIZRXIIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N3O/c1-6(4-3-5-9)7(10)8(12)11-2/h6-7H,3-4,10H2,1-2H3,(H,11,12).
What are the key properties of 2-amino-5-cyano-N,3-dimethylpentanamide?
2-amino-5-cyano-N,3-dimethylpentanamide has a molecular weight of 169.23 g/mol, XLogP of -0.00, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-cyano-N,3-dimethylpentanamide is sourced from PubChem (CID 174428654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).