N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide

C24H35N3O4S — CID 20901002

IUPACN-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide
SMILESCN1C(=O)C(C)(C)c2cc(S(=O)(=O)NCC3CCC(C(=O)NC4CCCC4)CC3)ccc21
InChIInChI=1S/C24H35N3O4S/c1-24(2)20-14-19(12-13-21(20)27(3)23(24)29)32(30,31)25-15-16-8-10-17(11-9-16)22(28)26-18-6-4-5-7-18/h12-14,16-18,25H,4-11,15H2,1-3H3,(H,26,28)
InChIKeyINCRGEHXKWJNMO-UHFFFAOYSA-N
MW461.63 g/mol
LogP3.08
Rot. Bonds6

About N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide

N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide (PubChem CID 20901002) has the molecular formula C24H35N3O4S and a molecular weight of 461.63 g/mol. Its IUPAC name is N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide
PubChem CID20901002
Molecular FormulaC24H35N3O4S
Molecular Weight461.63 g/mol
Exact Mass461.23
IUPAC NameN-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide
SMILESCN1C(=O)C(C)(C)c2cc(S(=O)(=O)NCC3CCC(C(=O)NC4CCCC4)CC3)ccc21
InChIInChI=1S/C24H35N3O4S/c1-24(2)20-14-19(12-13-21(20)27(3)23(24)29)32(30,31)25-15-16-8-10-17(11-9-16)22(28)26-18-6-4-5-7-18/h12-14,16-18,25H,4-11,15H2,1-3H3,(H,26,28)
InChIKeyINCRGEHXKWJNMO-UHFFFAOYSA-N
XLogP3.08
TPSA95.58 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms32
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500461.63
LogP ≤ 53.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide with MolForge

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Related Compounds

1,3,3-trimethyl-2-oxo-N-[[4-(pyrrolidine-1-carbonyl)cyclohexyl]methyl]indole-5-sulfonamide
CID 20901007
N-(2,4-dimethylphenyl)-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide
CID 20901008
N-(1-phenylethyl)-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide
CID 20901009
1,3,3-trimethyl-N-[[4-(4-methylpiperidine-1-carbonyl)cyclohexyl]methyl]-2-oxoindole-5-sulfonamide
CID 20901006
N-cyclohexyl-1-(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylpyrrolidine-2-carboxamide
CID 46274726
4-[[(4-chlorophenyl)sulfonylamino]methyl]-N-cyclooctylcyclohexane-1-carboxamide
CID 5323384
N-butyl-1,3,3-trimethyl-2-oxoindole-5-sulfonamide
CID 22582606
N-[6-[(1-methylpiperidin-4-yl)methylsulfamoyl]-2,3-dihydro-1H-inden-1-yl]cyclopentanecarboxamide
CID 110248720
4-[[(1-acetyl-2-methyl-2,3-dihydroindol-5-yl)sulfonylamino]methyl]-N-(2-methylcyclohexyl)cyclohexane-1-carboxamide
CID 20903301
N-(cyclopentylmethyl)-1-methyl-2-oxo-3,4-dihydroquinoline-6-sulfonamide
CID 110627587
N-[2-(1,3,3-trimethyl-2-oxoindol-5-yl)ethyl]cyclopropanecarboxamide
CID 110790327
(2S,3S)-3-methyl-2-[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]pentanoic acid
CID 92863742

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide?
The IUPAC name of N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide (CID 20901002) is N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide.
What is the SMILES notation for N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide?
The canonical SMILES for N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide is CN1C(=O)C(C)(C)c2cc(S(=O)(=O)NCC3CCC(C(=O)NC4CCCC4)CC3)ccc21.
What is the InChIKey of N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide?
The InChIKey is INCRGEHXKWJNMO-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H35N3O4S/c1-24(2)20-14-19(12-13-21(20)27(3)23(24)29)32(30,31)25-15-16-8-10-17(11-9-16)22(28)26-18-6-4-5-7-18/h12-14,16-18,25H,4-11,15H2,1-3H3,(H,26,28).
What are the key properties of N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide?
N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide has a molecular weight of 461.63 g/mol, XLogP of 3.08, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-4-[[(1,3,3-trimethyl-2-oxoindol-5-yl)sulfonylamino]methyl]cyclohexane-1-carboxamide is sourced from PubChem (CID 20901002), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).