N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide

C15H26N2O2S2 — CID 2317335

IUPACN-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide
SMILESCN(CC(C)(C)NS(=O)(=O)c1cccs1)C1CCCCC1
InChIInChI=1S/C15H26N2O2S2/c1-15(2,12-17(3)13-8-5-4-6-9-13)16-21(18,19)14-10-7-11-20-14/h7,10-11,13,16H,4-6,8-9,12H2,1-3H3
InChIKeyVDOUMXWCPOUJGB-UHFFFAOYSA-N
MW330.52 g/mol
LogP3.07
Rot. Bonds6

About N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide

N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide (PubChem CID 2317335) has the molecular formula C15H26N2O2S2 and a molecular weight of 330.52 g/mol. Its IUPAC name is N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide.

Molecular Properties

Compound NameN-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide
PubChem CID2317335
Molecular FormulaC15H26N2O2S2
Molecular Weight330.52 g/mol
Exact Mass330.14
IUPAC NameN-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide
SMILESCN(CC(C)(C)NS(=O)(=O)c1cccs1)C1CCCCC1
InChIInChI=1S/C15H26N2O2S2/c1-15(2,12-17(3)13-8-5-4-6-9-13)16-21(18,19)14-10-7-11-20-14/h7,10-11,13,16H,4-6,8-9,12H2,1-3H3
InChIKeyVDOUMXWCPOUJGB-UHFFFAOYSA-N
XLogP3.07
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.52
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The IUPAC name of N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide (CID 2317335) is N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide.
What is the SMILES notation for N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The canonical SMILES for N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide is CN(CC(C)(C)NS(=O)(=O)c1cccs1)C1CCCCC1.
What is the InChIKey of N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide?
The InChIKey is VDOUMXWCPOUJGB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2S2/c1-15(2,12-17(3)13-8-5-4-6-9-13)16-21(18,19)14-10-7-11-20-14/h7,10-11,13,16H,4-6,8-9,12H2,1-3H3.
What are the key properties of N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide?
N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide has a molecular weight of 330.52 g/mol, XLogP of 3.07, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[1-[cyclohexyl(methyl)amino]-2-methylpropan-2-yl]thiophene-2-sulfonamide is sourced from PubChem (CID 2317335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).