N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide

C18H24N2O3S — CID 751500

IUPACN-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide
SMILESCCn1cc(S(=O)(=O)CC(=O)NC2CCCCC2)c2ccccc21
InChIInChI=1S/C18H24N2O3S/c1-2-20-12-17(15-10-6-7-11-16(15)20)24(22,23)13-18(21)19-14-8-4-3-5-9-14/h6-7,10-12,14H,2-5,8-9,13H2,1H3,(H,19,21)
InChIKeyQOXKBPDGLJQQEP-UHFFFAOYSA-N
MW348.47 g/mol
LogP2.88
Rot. Bonds5

About N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide

N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide (PubChem CID 751500) has the molecular formula C18H24N2O3S and a molecular weight of 348.47 g/mol. Its IUPAC name is N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide.

Molecular Properties

Compound NameN-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide
PubChem CID751500
Molecular FormulaC18H24N2O3S
Molecular Weight348.47 g/mol
Exact Mass348.15
IUPAC NameN-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide
SMILESCCn1cc(S(=O)(=O)CC(=O)NC2CCCCC2)c2ccccc21
InChIInChI=1S/C18H24N2O3S/c1-2-20-12-17(15-10-6-7-11-16(15)20)24(22,23)13-18(21)19-14-8-4-3-5-9-14/h6-7,10-12,14H,2-5,8-9,13H2,1H3,(H,19,21)
InChIKeyQOXKBPDGLJQQEP-UHFFFAOYSA-N
XLogP2.88
TPSA68.17 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.47
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide?
The IUPAC name of N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide (CID 751500) is N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide.
What is the SMILES notation for N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide?
The canonical SMILES for N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide is CCn1cc(S(=O)(=O)CC(=O)NC2CCCCC2)c2ccccc21.
What is the InChIKey of N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide?
The InChIKey is QOXKBPDGLJQQEP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O3S/c1-2-20-12-17(15-10-6-7-11-16(15)20)24(22,23)13-18(21)19-14-8-4-3-5-9-14/h6-7,10-12,14H,2-5,8-9,13H2,1H3,(H,19,21).
What are the key properties of N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide?
N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide has a molecular weight of 348.47 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-2-(1-ethylindol-3-yl)sulfonylacetamide is sourced from PubChem (CID 751500), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).