(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide

C7H15NO5 — CID 91224788

IUPAC(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide
SMILESCCNC(=O)[C@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C7H15NO5/c1-2-8-7(13)6(12)5(11)4(10)3-9/h4-6,9-12H,2-3H2,1H3,(H,8,13)/t4-,5-,6-/m1/s1
InChIKeyASKIJFFPUHVGAJ-HSUXUTPPSA-N
MW193.20 g/mol
LogP-2.80
Rot. Bonds5

About (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide

(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide (PubChem CID 91224788) has the molecular formula C7H15NO5 and a molecular weight of 193.20 g/mol. Its IUPAC name is (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide.

Molecular Properties

Compound Name(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide
PubChem CID91224788
Molecular FormulaC7H15NO5
Molecular Weight193.20 g/mol
Exact Mass193.10
IUPAC Name(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide
SMILESCCNC(=O)[C@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C7H15NO5/c1-2-8-7(13)6(12)5(11)4(10)3-9/h4-6,9-12H,2-3H2,1H3,(H,8,13)/t4-,5-,6-/m1/s1
InChIKeyASKIJFFPUHVGAJ-HSUXUTPPSA-N
XLogP-2.80
TPSA110.02 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.20
LogP ≤ 5-2.80
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(3S,4R)-N-ethyl-2,3,4,5,6-pentahydroxyhexanamide
CID 138650369
ethane;N-ethyl-2,3,4,5,6-pentahydroxyhexanamide
CID 144926346
(2R,3S,4S)-2,3,4,5-tetrahydroxy-N-octylpentanamide
CID 175982166
(2R,3R,4S,5R,6R)-N-[2-[[(2R,3R,4S,5R,6R)-2,3,4,5,6,7-hexahydroxyheptanoyl]amino]ethyl]-2,3,4,5,6,7-hexahydroxyheptanamide
CID 102513201
(2R,3R,4S,5R)-2,3,4,5,6-pentahydroxy-N-[3-[[(2R,3R,4S,5R)-2,3,4,5,6-pentahydroxyhexanoyl]amino]propyl]hexanamide
CID 14403953
(2R,3R,4R,5R,6S)-N-butyl-2,3,4,5,6,7-hexahydroxyheptanamide
CID 124819757
N-(2-bromoethyl)-2,3,4,5,6-pentahydroxyhexanamide
CID 117069356
N-[2-[[(2R,3R,4R)-2,3,4,5-tetrahydroxypentanoyl]amino]ethyl]decanamide
CID 57405064
N-[2-[[(2R,3R,4R)-2,3,4,5-tetrahydroxypentanoyl]amino]ethyl]tetradecanamide
CID 57405062
2,3,4,5-tetrahydroxy-N-pentan-2-ylpentanamide
CID 130321877
2,3,4,5,6-pentahydroxy-N-prop-2-ynylhexanamide
CID 58210245
2,3,4,5,6-pentahydroxy-N-(3-methylbutyl)hexanamide
CID 135157558

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide?
The IUPAC name of (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide (CID 91224788) is (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide.
What is the SMILES notation for (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide?
The canonical SMILES for (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide is CCNC(=O)[C@H](O)[C@H](O)[C@H](O)CO.
What is the InChIKey of (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide?
The InChIKey is ASKIJFFPUHVGAJ-HSUXUTPPSA-N. The full InChI is InChI=1S/C7H15NO5/c1-2-8-7(13)6(12)5(11)4(10)3-9/h4-6,9-12H,2-3H2,1H3,(H,8,13)/t4-,5-,6-/m1/s1.
What are the key properties of (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide?
(2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide has a molecular weight of 193.20 g/mol, XLogP of -2.80, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R)-N-ethyl-2,3,4,5-tetrahydroxypentanamide is sourced from PubChem (CID 91224788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).