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

C5H10N2O2 — CID 23519305

IUPAC(4S)-4-amino-3-oxopentanamide
SMILESC[C@H](N)C(=O)CC(N)=O
InChIInChI=1S/C5H10N2O2/c1-3(6)4(8)2-5(7)9/h3H,2,6H2,1H3,(H2,7,9)/t3-/m0/s1
InChIKeyWFVWGOOSKFXECT-VKHMYHEASA-N
MW130.15 g/mol
LogP-1.22
Rot. Bonds3

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

(4S)-4-amino-3-oxopentanamide (PubChem CID 23519305) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (4S)-4-amino-3-oxopentanamide.

Molecular Properties

Compound Name(4S)-4-amino-3-oxopentanamide
PubChem CID23519305
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(4S)-4-amino-3-oxopentanamide
SMILESC[C@H](N)C(=O)CC(N)=O
InChIInChI=1S/C5H10N2O2/c1-3(6)4(8)2-5(7)9/h3H,2,6H2,1H3,(H2,7,9)/t3-/m0/s1
InChIKeyWFVWGOOSKFXECT-VKHMYHEASA-N
XLogP-1.22
TPSA86.18 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-1.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

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Related Compounds

5-amino-4-methyl-3-oxohexanamide
CID 123318073
4-amino-3-oxopentanoic acid
CID 134247354
4,5-dimethyl-3-oxohexanamide
CID 87390570
4-methyl-3-oxohexanamide
CID 91421150
1,3-diaminobutan-2-one
CID 18683672
2-aminopentan-3-one
CID 10986165
propanediamide
CID 7911
(3R)-3-amino-1-cyclopropylbutan-2-one
CID 96732436
2-aminopropanamide;dihydrochloride
CID 19963402
CID 86589108
CID 86589108
2-aminopropanamide;ethane
CID 156828005
methyl (5R)-5-amino-2-hydroxy-4-oxohexanoate
CID 174417154

Frequently Asked Questions

What is the IUPAC name of (4S)-4-amino-3-oxopentanamide?
The IUPAC name of (4S)-4-amino-3-oxopentanamide (CID 23519305) is (4S)-4-amino-3-oxopentanamide.
What is the SMILES notation for (4S)-4-amino-3-oxopentanamide?
The canonical SMILES for (4S)-4-amino-3-oxopentanamide is C[C@H](N)C(=O)CC(N)=O.
What is the InChIKey of (4S)-4-amino-3-oxopentanamide?
The InChIKey is WFVWGOOSKFXECT-VKHMYHEASA-N. The full InChI is InChI=1S/C5H10N2O2/c1-3(6)4(8)2-5(7)9/h3H,2,6H2,1H3,(H2,7,9)/t3-/m0/s1.
What are the key properties of (4S)-4-amino-3-oxopentanamide?
(4S)-4-amino-3-oxopentanamide has a molecular weight of 130.15 g/mol, XLogP of -1.22, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4S)-4-amino-3-oxopentanamide is sourced from PubChem (CID 23519305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).