(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron

C5H9NO4 — CID 88747398

💊View drug profile → glutamic acid
IUPAC(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron
SMILESN[C@@H](CCC(=O)O)C(=O)[O-].[H+]
InChIInChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKeyWHUUTDBJXJRKMK-VKHMYHEASA-N
MW147.13 g/mol
LogP-1.96
Rot. Bonds4

About (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron

(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron (PubChem CID 88747398) has the molecular formula C5H9NO4 and a molecular weight of 147.13 g/mol. Its IUPAC name is (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron.

Molecular Properties

Compound Name(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron
PubChem CID88747398
Molecular FormulaC5H9NO4
Molecular Weight147.13 g/mol
Exact Mass147.05
IUPAC Name(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron
SMILESN[C@@H](CCC(=O)O)C(=O)[O-].[H+]
InChIInChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1
InChIKeyWHUUTDBJXJRKMK-VKHMYHEASA-N
XLogP-1.96
TPSA103.45 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500147.13
LogP ≤ 5-1.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

L-Glutamic Acid
CID 33032
D-Glutamic Acid
CID 23327
DL-Glutamic acid
CID 611
Glutamic Acid Hydrochloride
CID 2723891
Monosodium Glutamate
CID 23689119
Sodium Glutamate
CID 23672308
L-Norvaline
CID 65098
Glutamate(2-)
CID 5128032
N-methyl-L-glutamic acid
CID 439377
D-Norvaline
CID 439575
Monopotassium glutamate
CID 23695977
Glutamate(1-)
CID 4525487

Frequently Asked Questions

What is the IUPAC name of (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron?
The IUPAC name of (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron (CID 88747398) is (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron.
What is the SMILES notation for (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron?
The canonical SMILES for (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron is N[C@@H](CCC(=O)O)C(=O)[O-].[H+].
What is the InChIKey of (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron?
The InChIKey is WHUUTDBJXJRKMK-VKHMYHEASA-N. The full InChI is InChI=1S/C5H9NO4/c6-3(5(9)10)1-2-4(7)8/h3H,1-2,6H2,(H,7,8)(H,9,10)/t3-/m0/s1.
What are the key properties of (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron?
(2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron has a molecular weight of 147.13 g/mol, XLogP of -1.96, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-amino-5-hydroxy-5-oxopentanoate;hydron is sourced from PubChem (CID 88747398), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).