(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide

C11H15NO5 — CID 54295332

IUPAC(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide
SMILESO=C(Nc1ccccc1)[C@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C11H15NO5/c13-6-8(14)9(15)10(16)11(17)12-7-4-2-1-3-5-7/h1-5,8-10,13-16H,6H2,(H,12,17)/t8-,9-,10-/m1/s1
InChIKeySAJYVZIPVNGGCE-OPRDCNLKSA-N
MW241.24 g/mol
LogP-1.30
Rot. Bonds5

About (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide

(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide (PubChem CID 54295332) has the molecular formula C11H15NO5 and a molecular weight of 241.24 g/mol. Its IUPAC name is (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide.

Molecular Properties

Compound Name(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide
PubChem CID54295332
Molecular FormulaC11H15NO5
Molecular Weight241.24 g/mol
Exact Mass241.10
IUPAC Name(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide
SMILESO=C(Nc1ccccc1)[C@H](O)[C@H](O)[C@H](O)CO
InChIInChI=1S/C11H15NO5/c13-6-8(14)9(15)10(16)11(17)12-7-4-2-1-3-5-7/h1-5,8-10,13-16H,6H2,(H,12,17)/t8-,9-,10-/m1/s1
InChIKeySAJYVZIPVNGGCE-OPRDCNLKSA-N
XLogP-1.30
TPSA110.02 Ų
H-Bond Donors5
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.24
LogP ≤ 5-1.30
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 105

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Related Compounds

(2S,3R,4R,5R,6R)-2,3,4,5,6,7-hexahydroxy-N-phenylheptanamide
CID 7921985
(2R,3R,4R)-N-(4-aminophenyl)-2,3,4,5-tetrahydroxypentanamide
CID 54431167
hexane-1,2,3,4,5,6-hexol;phenylcarbamic acid
CID 54607151
(2R,4R,5R,6R)-2,4,5,6,7-pentahydroxy-3-oxo-N'-phenylheptanehydrazide
CID 92532681
(2R,4S,5R,6R)-2,4,5,6,7-pentahydroxy-3-oxo-N'-phenylheptanehydrazide
CID 98572843
2,3-dihydroxy-N-phenylpropanamide;hydrate
CID 141005572
(2S,3R,4S)-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydroxypentanamide
CID 6991445
(2R,3S,4R,5R)-2,3,4,5,6-pentahydroxy-N-(4-methoxyphenyl)hexanamide
CID 72548867
(2R,3S,4R)-N-(3,4-dimethylphenyl)-2,3,4,5-tetrahydroxypentanamide
CID 1097617
(2R,3R,4S,5R,6R)-N-(2-aminophenyl)-2,3,4,5,6,7-hexahydroxyheptanamide
CID 102513203
(2R,3R,4R,5S)-2,3,4,5,6-pentahydroxy-N-(2-phenylethyl)hexanamide
CID 92529727
(2R)-3-amino-2-hydroxy-N-phenylpropanamide
CID 91043258

Frequently Asked Questions

What is the IUPAC name of (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide?
The IUPAC name of (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide (CID 54295332) is (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide.
What is the SMILES notation for (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide?
The canonical SMILES for (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide is O=C(Nc1ccccc1)[C@H](O)[C@H](O)[C@H](O)CO.
What is the InChIKey of (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide?
The InChIKey is SAJYVZIPVNGGCE-OPRDCNLKSA-N. The full InChI is InChI=1S/C11H15NO5/c13-6-8(14)9(15)10(16)11(17)12-7-4-2-1-3-5-7/h1-5,8-10,13-16H,6H2,(H,12,17)/t8-,9-,10-/m1/s1.
What are the key properties of (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide?
(2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide has a molecular weight of 241.24 g/mol, XLogP of -1.30, 5 rotatable bonds, 5 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R,3R,4R)-2,3,4,5-tetrahydroxy-N-phenylpentanamide is sourced from PubChem (CID 54295332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).