(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide

C13H14N2O4S — CID 154155267

IUPAC(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide
SMILESNC(=O)[C@@](N)(CO)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O4S/c14-12(17)13(15,8-16)20(18,19)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,16H,8,15H2,(H2,14,17)/t13-/m1/s1
InChIKeyLRKUBDXZMCGMKZ-CYBMUJFWSA-N
MW294.33 g/mol
LogP-0.25
Rot. Bonds4

About (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide

(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide (PubChem CID 154155267) has the molecular formula C13H14N2O4S and a molecular weight of 294.33 g/mol. Its IUPAC name is (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide.

Molecular Properties

Compound Name(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide
PubChem CID154155267
Molecular FormulaC13H14N2O4S
Molecular Weight294.33 g/mol
Exact Mass294.07
IUPAC Name(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide
SMILESNC(=O)[C@@](N)(CO)S(=O)(=O)c1ccc2ccccc2c1
InChIInChI=1S/C13H14N2O4S/c14-12(17)13(15,8-16)20(18,19)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,16H,8,15H2,(H2,14,17)/t13-/m1/s1
InChIKeyLRKUBDXZMCGMKZ-CYBMUJFWSA-N
XLogP-0.25
TPSA123.48 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.33
LogP ≤ 5-0.25
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Related Compounds

naphthalene-2-sulfonic acid
CID 8420
2-[methyl(naphthalen-2-ylsulfonyl)amino]acetamide
CID 977503
benzamide;naphthalene-2-sulfonamide
CID 160825471
naphthalene-2-sulfonic acid;zinc
CID 87263273
CID 88530425
CID 88530425
CID 87246277
CID 87246277
Dispersing Agent NNO
CID 156594502
3-naphthalen-2-ylsulfonylpropane-1-sulfonamide
CID 56801860
diethyl 2-naphthalen-2-ylsulfonylpropanedioate
CID 134066731
methanesulfonic acid;naphthalene-2-sulfonic acid
CID 87841078
(2S)-2-(naphthalen-2-ylsulfonylamino)-2-phenylacetamide
CID 51472155
tetracene-2-sulfonic acid
CID 21483873

Frequently Asked Questions

What is the IUPAC name of (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide?
The IUPAC name of (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide (CID 154155267) is (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide.
What is the SMILES notation for (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide?
The canonical SMILES for (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide is NC(=O)[C@@](N)(CO)S(=O)(=O)c1ccc2ccccc2c1.
What is the InChIKey of (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide?
The InChIKey is LRKUBDXZMCGMKZ-CYBMUJFWSA-N. The full InChI is InChI=1S/C13H14N2O4S/c14-12(17)13(15,8-16)20(18,19)11-6-5-9-3-1-2-4-10(9)7-11/h1-7,16H,8,15H2,(H2,14,17)/t13-/m1/s1.
What are the key properties of (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide?
(2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide has a molecular weight of 294.33 g/mol, XLogP of -0.25, 4 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-amino-3-hydroxy-2-naphthalen-2-ylsulfonylpropanamide is sourced from PubChem (CID 154155267), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).