(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide

C12H18N2O3S — CID 670213

IUPAC(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
SMILESCCC[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-3-4-9(2)12(15)14-10-5-7-11(8-6-10)18(13,16)17/h5-9H,3-4H2,1-2H3,(H,14,15)(H2,13,16,17)/t9-/m1/s1
InChIKeyQSFJQYWMTFBTCD-SECBINFHSA-N
MW270.35 g/mol
LogP1.71
Rot. Bonds5

About (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide

(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide (PubChem CID 670213) has the molecular formula C12H18N2O3S and a molecular weight of 270.35 g/mol. Its IUPAC name is (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide.

Molecular Properties

Compound Name(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
PubChem CID670213
Molecular FormulaC12H18N2O3S
Molecular Weight270.35 g/mol
Exact Mass270.10
IUPAC Name(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide
SMILESCCC[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1
InChIInChI=1S/C12H18N2O3S/c1-3-4-9(2)12(15)14-10-5-7-11(8-6-10)18(13,16)17/h5-9H,3-4H2,1-2H3,(H,14,15)(H2,13,16,17)/t9-/m1/s1
InChIKeyQSFJQYWMTFBTCD-SECBINFHSA-N
XLogP1.71
TPSA89.26 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.35
LogP ≤ 51.71
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-2-amino-N-(4-sulfamoylphenyl)pentanamide
CID 107568013
2-methyl-3-(methylamino)-N-(4-sulfamoylphenyl)propanamide
CID 79195981
(2S)-N-(4-acetamidophenyl)-2-methylpentanamide
CID 670216
N-(3-chloro-4-sulfamoylphenyl)-2-methylpentanamide
CID 43246501
N-(4-hydroxyphenyl)-2-methylpentanamide
CID 43210200
2-methyl-N-phenylpentanamide
CID 4627801
3-amino-N-(4-ethylsulfonylphenyl)-2-methylpropanamide
CID 62669246
(2R)-2-bromo-N-(4-sulfamoylphenyl)butanamide
CID 94883529
[amino-[4-(2-methylpentanoylamino)phenyl]methylidene]azanium
CID 21349582
1-pentan-2-yl-3-(4-sulfamoylphenyl)thiourea
CID 19652353
N-(4-carbamothioylphenyl)-2-methylpentanamide
CID 43210162
3-(3,4-dihydroxyphenyl)-2-methyl-N-(4-sulfamoylphenyl)propanamide
CID 84578792

Frequently Asked Questions

What is the IUPAC name of (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide?
The IUPAC name of (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide (CID 670213) is (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide.
What is the SMILES notation for (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide?
The canonical SMILES for (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide is CCC[C@@H](C)C(=O)Nc1ccc(S(N)(=O)=O)cc1.
What is the InChIKey of (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide?
The InChIKey is QSFJQYWMTFBTCD-SECBINFHSA-N. The full InChI is InChI=1S/C12H18N2O3S/c1-3-4-9(2)12(15)14-10-5-7-11(8-6-10)18(13,16)17/h5-9H,3-4H2,1-2H3,(H,14,15)(H2,13,16,17)/t9-/m1/s1.
What are the key properties of (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide?
(2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide has a molecular weight of 270.35 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-methyl-N-(4-sulfamoylphenyl)pentanamide is sourced from PubChem (CID 670213), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).