N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide

C17H24N2O3S — CID 136545712

IUPACN-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide
SMILESCNS(=O)(=O)C1CCN(C(=O)c2cccc3c2CCCC3)CC1
InChIInChI=1S/C17H24N2O3S/c1-18-23(21,22)14-9-11-19(12-10-14)17(20)16-8-4-6-13-5-2-3-7-15(13)16/h4,6,8,14,18H,2-3,5,7,9-12H2,1H3
InChIKeyMBPBMHHYEMVQSI-UHFFFAOYSA-N
MW336.46 g/mol
LogP1.72
Rot. Bonds3

About N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide

N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide (PubChem CID 136545712) has the molecular formula C17H24N2O3S and a molecular weight of 336.46 g/mol. Its IUPAC name is N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide.

Molecular Properties

Compound NameN-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide
PubChem CID136545712
Molecular FormulaC17H24N2O3S
Molecular Weight336.46 g/mol
Exact Mass336.15
IUPAC NameN-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide
SMILESCNS(=O)(=O)C1CCN(C(=O)c2cccc3c2CCCC3)CC1
InChIInChI=1S/C17H24N2O3S/c1-18-23(21,22)14-9-11-19(12-10-14)17(20)16-8-4-6-13-5-2-3-7-15(13)16/h4,6,8,14,18H,2-3,5,7,9-12H2,1H3
InChIKeyMBPBMHHYEMVQSI-UHFFFAOYSA-N
XLogP1.72
TPSA66.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500336.46
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2,3-dihydro-1H-indene-4-carbonyl)-N-methylpiperazine-1-sulfonamide
CID 138997186
(3S)-1-(2,3-dihydro-1H-indene-4-carbonyl)pyrrolidine-3-carboxylic acid
CID 124610702
(2-methyl-1,4-oxazepan-4-yl)-(5,6,7,8-tetrahydronaphthalen-1-yl)methanone
CID 136545688
2,3-dihydro-1H-inden-4-yl-(3,5-dimethylpiperazin-1-yl)methanone
CID 119564206
2,3-dihydro-1H-inden-4-yl-[4-(5,6-dihydro-4H-pyrrolo[3,4-d]pyrazol-1-yl)piperidin-1-yl]methanone
CID 128883392
4-[1-(2,3-dihydro-1H-indene-4-carbonyl)piperidin-4-yl]oxybenzonitrile
CID 127281932
3-[1-(2,3-dihydro-1H-indene-4-carbonyl)piperidin-4-yl]-1,2-oxazole-5-carboxylic acid
CID 136560207
1-(3,4-dihydro-1H-isochromene-8-carbonyl)piperidine-4-carboxylic acid
CID 154798587
(2R,3R)-1-(2,3-dihydro-1H-indene-4-carbonyl)-2-methylpiperidine-3-carboxylic acid
CID 122114525
2-[1-(2-fluorobenzoyl)piperidin-4-yl]sulfonyl-N-methylacetamide
CID 90592510
2,3-dihydro-1H-inden-4-yl-[4-methyl-3-(1-methylimidazol-2-yl)piperazin-1-yl]methanone
CID 128992767
1-(5,6,7,8-tetrahydronaphthalen-1-yl)propan-1-one
CID 14994244

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide?
The IUPAC name of N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide (CID 136545712) is N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide.
What is the SMILES notation for N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide?
The canonical SMILES for N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide is CNS(=O)(=O)C1CCN(C(=O)c2cccc3c2CCCC3)CC1.
What is the InChIKey of N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide?
The InChIKey is MBPBMHHYEMVQSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O3S/c1-18-23(21,22)14-9-11-19(12-10-14)17(20)16-8-4-6-13-5-2-3-7-15(13)16/h4,6,8,14,18H,2-3,5,7,9-12H2,1H3.
What are the key properties of N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide?
N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide has a molecular weight of 336.46 g/mol, XLogP of 1.72, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5,6,7,8-tetrahydronaphthalene-1-carbonyl)piperidine-4-sulfonamide is sourced from PubChem (CID 136545712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).