(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide

C5H11N3O3 — CID 88513048

IUPAC(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide
SMILESNC(=O)C[C@H](N)C(=O)CNO
InChIInChI=1S/C5H11N3O3/c6-3(1-5(7)10)4(9)2-8-11/h3,8,11H,1-2,6H2,(H2,7,10)/t3-/m0/s1
InChIKeyRDMOUDMUUOUJLL-VKHMYHEASA-N
MW161.16 g/mol
LogP-2.26
Rot. Bonds5

About (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide

(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide (PubChem CID 88513048) has the molecular formula C5H11N3O3 and a molecular weight of 161.16 g/mol. Its IUPAC name is (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide.

Molecular Properties

Compound Name(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide
PubChem CID88513048
Molecular FormulaC5H11N3O3
Molecular Weight161.16 g/mol
Exact Mass161.08
IUPAC Name(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide
SMILESNC(=O)C[C@H](N)C(=O)CNO
InChIInChI=1S/C5H11N3O3/c6-3(1-5(7)10)4(9)2-8-11/h3,8,11H,1-2,6H2,(H2,7,10)/t3-/m0/s1
InChIKeyRDMOUDMUUOUJLL-VKHMYHEASA-N
XLogP-2.26
TPSA118.44 Ų
H-Bond Donors4
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500161.16
LogP ≤ 5-2.26
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

(3R)-3-amino-4-oxohexanamide
CID 139478456
(2R)-2,4-diamino-4-oxobutanoate
CID 5460878
bis(2,4-diamino-4-oxobutanoic acid);palladium
CID 3531876
(2R)-2,4-diamino-4-oxobutanoic acid;hydrochloride
CID 135331136
2-amino-N-carbamoylbutanediamide
CID 79194218
magnesium;(2S)-2,4-diamino-4-oxobutanoic acid;hydride
CID 174719447
2-amino-N-(2,2-dihydroxyethyl)butanediamide
CID 154111575
tetrakis(2-aminoacetic acid);2,4-diamino-4-oxobutanoic acid
CID 21226082
(2S)-2-aminobutanedioic acid;azane;(2S)-2,4-diamino-4-oxobutanoic acid
CID 173165930
pentakis(2-aminoacetic acid);bis(2,4-diamino-4-oxobutanoic acid)
CID 18680457
hexakis(2-aminoacetic acid);2,4-diamino-4-oxobutanoic acid
CID 22648435
2-aminoacetamide;2-aminoacetic acid;2,4-diamino-4-oxobutanoic acid
CID 18676827

Frequently Asked Questions

What is the IUPAC name of (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide?
The IUPAC name of (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide (CID 88513048) is (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide.
What is the SMILES notation for (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide?
The canonical SMILES for (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide is NC(=O)C[C@H](N)C(=O)CNO.
What is the InChIKey of (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide?
The InChIKey is RDMOUDMUUOUJLL-VKHMYHEASA-N. The full InChI is InChI=1S/C5H11N3O3/c6-3(1-5(7)10)4(9)2-8-11/h3,8,11H,1-2,6H2,(H2,7,10)/t3-/m0/s1.
What are the key properties of (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide?
(3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide has a molecular weight of 161.16 g/mol, XLogP of -2.26, 5 rotatable bonds, 4 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-3-amino-5-(hydroxyamino)-4-oxopentanamide is sourced from PubChem (CID 88513048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).