(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide

C18H22N2O5S — CID 1210914

IUPAC(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(OC)c(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O5S/c1-12-5-8-15(9-6-12)26(22,23)20-13(2)18(21)19-16-11-14(24-3)7-10-17(16)25-4/h5-11,13,20H,1-4H3,(H,19,21)/t13-/m1/s1
InChIKeyFBHPRKRGKAUVBJ-CYBMUJFWSA-N
MW378.45 g/mol
LogP2.32
Rot. Bonds7

About (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide

(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide (PubChem CID 1210914) has the molecular formula C18H22N2O5S and a molecular weight of 378.45 g/mol. Its IUPAC name is (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide.

Molecular Properties

Compound Name(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
PubChem CID1210914
Molecular FormulaC18H22N2O5S
Molecular Weight378.45 g/mol
Exact Mass378.12
IUPAC Name(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
SMILESCOc1ccc(OC)c(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)c1
InChIInChI=1S/C18H22N2O5S/c1-12-5-8-15(9-6-12)26(22,23)20-13(2)18(21)19-16-11-14(24-3)7-10-17(16)25-4/h5-11,13,20H,1-4H3,(H,19,21)/t13-/m1/s1
InChIKeyFBHPRKRGKAUVBJ-CYBMUJFWSA-N
XLogP2.32
TPSA93.73 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500378.45
LogP ≤ 52.32
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-[(4-chlorophenyl)sulfonylamino]-N-(2,5-dimethoxyphenyl)propanamide
CID 7318747
(2R)-N-(2,5-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339684
(2S)-N-(4-methoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide
CID 40534613
(2S)-N-(2,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 7473390
(2R)-N-(2,5-dimethylphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 7473389
(2R)-N-(2,4-dimethoxyphenyl)-2-[(3,4-dimethoxyphenyl)sulfonylamino]propanamide
CID 41339682
2-[(3,4-dimethoxyphenyl)sulfonylamino]-N-(4-methylphenyl)propanamide
CID 5253893
N-(3,4-dimethoxyphenyl)-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 3918637
(2S)-N-[3-(methanesulfonamido)-4-methoxyphenyl]-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 37065929
N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]acetamide
CID 21383211
(2S)-N-[2-(2-methoxyethoxy)-4-methylphenyl]-2-[(4-methoxyphenyl)sulfonylamino]propanamide
CID 55950157
(2S)-2-[(4-acetamidophenyl)sulfonylamino]-N-(2-butoxy-5-methoxyphenyl)propanamide
CID 39471769

Frequently Asked Questions

What is the IUPAC name of (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The IUPAC name of (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide (CID 1210914) is (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide.
What is the SMILES notation for (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The canonical SMILES for (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide is COc1ccc(OC)c(NC(=O)[C@@H](C)NS(=O)(=O)c2ccc(C)cc2)c1.
What is the InChIKey of (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
The InChIKey is FBHPRKRGKAUVBJ-CYBMUJFWSA-N. The full InChI is InChI=1S/C18H22N2O5S/c1-12-5-8-15(9-6-12)26(22,23)20-13(2)18(21)19-16-11-14(24-3)7-10-17(16)25-4/h5-11,13,20H,1-4H3,(H,19,21)/t13-/m1/s1.
What are the key properties of (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide?
(2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide has a molecular weight of 378.45 g/mol, XLogP of 2.32, 7 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-N-(2,5-dimethoxyphenyl)-2-[(4-methylphenyl)sulfonylamino]propanamide is sourced from PubChem (CID 1210914), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).