(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane

C11H26N2O2S — CID 143144135

IUPAC(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane
SMILESCCC(C)N(C)S(=O)(=O)N[C@H](C)CC(C)C
InChIInChI=1S/C11H26N2O2S/c1-7-11(5)13(6)16(14,15)12-10(4)8-9(2)3/h9-12H,7-8H2,1-6H3/t10-,11?/m1/s1
InChIKeyXGMWYWJENCTEJZ-NFJWQWPMSA-N
MW250.41 g/mol
LogP1.99
Rot. Bonds7

About (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane

(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane (PubChem CID 143144135) has the molecular formula C11H26N2O2S and a molecular weight of 250.41 g/mol. Its IUPAC name is (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane.

Molecular Properties

Compound Name(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane
PubChem CID143144135
Molecular FormulaC11H26N2O2S
Molecular Weight250.41 g/mol
Exact Mass250.17
IUPAC Name(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane
SMILESCCC(C)N(C)S(=O)(=O)N[C@H](C)CC(C)C
InChIInChI=1S/C11H26N2O2S/c1-7-11(5)13(6)16(14,15)12-10(4)8-9(2)3/h9-12H,7-8H2,1-6H3/t10-,11?/m1/s1
InChIKeyXGMWYWJENCTEJZ-NFJWQWPMSA-N
XLogP1.99
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.41
LogP ≤ 51.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane?
The IUPAC name of (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane (CID 143144135) is (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane.
What is the SMILES notation for (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane?
The canonical SMILES for (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane is CCC(C)N(C)S(=O)(=O)N[C@H](C)CC(C)C.
What is the InChIKey of (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane?
The InChIKey is XGMWYWJENCTEJZ-NFJWQWPMSA-N. The full InChI is InChI=1S/C11H26N2O2S/c1-7-11(5)13(6)16(14,15)12-10(4)8-9(2)3/h9-12H,7-8H2,1-6H3/t10-,11?/m1/s1.
What are the key properties of (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane?
(2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane has a molecular weight of 250.41 g/mol, XLogP of 1.99, 7 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[[butan-2-yl(methyl)sulfamoyl]amino]-4-methylpentane is sourced from PubChem (CID 143144135), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).