3-Methyl-2-ureido-pentanoic acid

HCID 482886
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Basic information

Standard SMILES
CCC(C)C(NC(N)=O)C(=O)O
InChIKey
AXURSAQTBIXUTE-UHFFFAOYSA-N
Molecular formula
C7H14N2O3
Average molar mass
174.2 g/mol
Monoisotopic mass
174.10044231

Names & identifiers

Preferred name
3-Methyl-2-ureido-pentanoic acid
IUPAC
2-(carbamoylamino)-3-methylpentanoic acid

Names & synonyms

3-methyl-2-ureido-pentanoic acid2-(carbamoylamino)-3-methylpentanoic acid26117-19-1N-carbamoylisoleucineN-Carbamyl-L-isoleucineOprea1_642229SCHEMBL65346733-Methyl-2-ureidopentanoic acidBBA11719AKOS000264082AKOS016879627EN300-04327
Show more names
Z56862687

Database identifiers

PubChem CID
482886

Properties

Computed structural properties

XLogP
-0.4
Topological polar surface area
92.4 Ų
Hydrogen bond donors
3
Hydrogen bond acceptors
3
Rotatable bonds
4
Heavy atoms
12

Related reactions

1 records
New reaction record

Compound notes

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