2-Acetamidopentanoic acid

C₇H₁₃NO₃CAS 7682-15-7159.18 g/mol

Open in Covalent MOL file

Amide Carboxylic acid

Properties

Molecular formula: C₇H₁₃NO₃
Molar mass: 159.18 g/mol
Exact mass: 159.0895 Da
logP: 0.38Crippen estimate
Polar surface area: 66.4 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 4

Hazards

No GHS classification is on file for this compound. That is not evidence that it is harmless. Search the SDS library

Identifiers

CAS number

7682-15-7

SMILES

CCCC(C(=O)O)NC(=O)C

InChIKey

BSYFPUSAWVWWDG-UHFFFAOYSA-N

InChI

InChI=1S/C7H13NO3/c1-3-4-6(7(10)11)8-5(2)9/h6H,3-4H2,1-2H3,(H,8,9)(H,10,11)

Weigh it out

Type any one amount. The others follow from the molar mass.

Names and synonyms

1 names

Ac-dl-nva-oh

Work with 2-Acetamidopentanoic acid

Predict the NMR spectrum1H and 13C shifts with multiplicities Make a solutionWhat to weigh for any molarity and volume Check drug-likenessLipinski, Veber and lead-likeness Isotope patternExact mass and the mass spectrum pattern

Similar compounds

N-Acetyl-dl-norleucine7682-16-881 % similar N-Acetyl-D-leucine19764-30-860 % similar (2S)-2-(((tert-Butoxy)carbonyl)amino)pentanoic acid53308-95-556 % similar Boc-D-nva-oh57521-85-456 % similar Ac-glu(otbu)-oh84192-88-155 % similar (S)-2-Acetamido-5-guanidinopentanoic acid dihydrate210545-23-652 % similar (S)-2-Acetamido-4-(tert-butoxy)-4-oxobutanoic acid117833-18-851 % similar Valproic acid99-66-150 % similar

Tanimoto similarity of circular fingerprints over the whole catalogue. All similar compounds

Same formula

Ethyl morpholine-2-carboxylate107904-06-3 Isovalerylglycine16284-60-9 N-Acetyl-D-valine17916-88-0 N-Acetylvaline3067-19-4 3-Morpholin-4-yl-propionic acid4497-04-5 4'-Tetrahydropyranylglycine53284-84-7 N-Formyl-L-leucine6113-61-7 (S)-2-Amino-2-(tetrahydro-2H-pyran-4-yl)acetic acid811842-25-8

Elsewhere

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