(2R)-2-Amino-3-methylbutanamide hydrochloride

C₅H₁₃ClN₂OCAS 133170-58-8152.62 g/mol

Open in Covalent MOL file

Amide Primary amine

Properties

Molecular formula: C₅H₁₃ClN₂O
Molar mass: 152.62 g/mol
Exact mass: 152.0716 Da
logP: -0.12Crippen estimate
Polar surface area: 69.1 Å²
H-bond donors / acceptors: 2 / 2
Rotatable bonds: 2
Stereocentres: Rin SMILES atom order

Identifiers

CAS number

133170-58-8

SMILES

CC(C)[C@H](C(=O)N)N.Cl

InChIKey

XFCNYSGKNAWXFL-PGMHMLKASA-N

InChI

InChI=1S/C5H12N2O.ClH/c1-3(2)4(6)5(7)8;/h3-4H,6H2,1-2H3,(H2,7,8);1H/t4-;/m1./s1

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Names and synonyms

1 names

H-D-Val-nh2 hcl

Work with (2R)-2-Amino-3-methylbutanamide hydrochloride

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

H-Ile-nh2 hcl10466-56-558 % similar Methyl DL-valinate hydrochloride5619-05-652 % similar Methyl L-valinate hydrochloride6306-52-152 % similar Methyl D-valinate hydrochloride7146-15-852 % similar (S)-Valine ethyl ester hydrochloride17609-47-147 % similar (±)-Valine ethyl ester hydrochloride23358-42-147 % similar D-Valine640-68-645 % similar Valine72-18-445 % similar

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

Elsewhere

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