(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid

C5H11NO5 — CID 135189043

IUPAC(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid
SMILESNC[C@H](O)[C@@H](O)[C@H](O)C(=O)O
InChIInChI=1S/C5H11NO5/c6-1-2(7)3(8)4(9)5(10)11/h2-4,7-9H,1,6H2,(H,10,11)/t2-,3+,4-/m0/s1
InChIKeyHTLCITWVEYLCKJ-NUNKFHFFSA-N
MW165.14 g/mol
LogP-2.89
Rot. Bonds4

About (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid

(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid (PubChem CID 135189043) has the molecular formula C5H11NO5 and a molecular weight of 165.14 g/mol. Its IUPAC name is (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid.

Molecular Properties

Compound Name(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid
PubChem CID135189043
Molecular FormulaC5H11NO5
Molecular Weight165.14 g/mol
Exact Mass165.06
IUPAC Name(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid
SMILESNC[C@H](O)[C@@H](O)[C@H](O)C(=O)O
InChIInChI=1S/C5H11NO5/c6-1-2(7)3(8)4(9)5(10)11/h2-4,7-9H,1,6H2,(H,10,11)/t2-,3+,4-/m0/s1
InChIKeyHTLCITWVEYLCKJ-NUNKFHFFSA-N
XLogP-2.89
TPSA124.01 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500165.14
LogP ≤ 5-2.89
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2R,3R,4R,5S)-6-aminohexane-1,2,3,4,5-pentol;(2R,3R,4S,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 87972607
2,3,4,5-tetrahydroxypentanoic acid
CID 10264
2,3,4-trihydroxyhexanedioic acid
CID 19899983
(2S,3S,4R)-2,3,4,6-tetrahydroxyhexanoic acid
CID 91281326
(2S,3R,4S,5S)-2,3,4,5-tetrahydroxyhexanedioic acid
CID 6857454
(2R,3S,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid
CID 6857450
(2S,3S,4R,5S)-6-amino-2,3,4,5-tetrahydroxy-6-oxohexanoic acid
CID 167483909
bis((2S,3S)-2,3-dihydroxybutanedioic acid);ethane-1,2-diamine
CID 133126863
(2S,3S)-2,3-dihydroxybutanedioic acid;ethane-1,2-diamine
CID 57365622
2-aminoacetic acid;(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxyhexanoic acid
CID 87894515
azane;(2S,3R,4S,5R)-2,3,4,5-tetrahydroxyhexanedioic acid
CID 90473080
acetic acid;(2R,3S,4R)-5-aminopentane-1,2,3,4-tetrol
CID 46915821

Frequently Asked Questions

What is the IUPAC name of (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid?
The IUPAC name of (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid (CID 135189043) is (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid.
What is the SMILES notation for (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid?
The canonical SMILES for (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid is NC[C@H](O)[C@@H](O)[C@H](O)C(=O)O.
What is the InChIKey of (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid?
The InChIKey is HTLCITWVEYLCKJ-NUNKFHFFSA-N. The full InChI is InChI=1S/C5H11NO5/c6-1-2(7)3(8)4(9)5(10)11/h2-4,7-9H,1,6H2,(H,10,11)/t2-,3+,4-/m0/s1.
What are the key properties of (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid?
(2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid has a molecular weight of 165.14 g/mol, XLogP of -2.89, 4 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S,3R,4S)-5-amino-2,3,4-trihydroxypentanoic acid is sourced from PubChem (CID 135189043), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).