(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide

C13H26N2O2S — CID 95301387

IUPAC(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(C)CN(C1CC1)S(=O)(=O)N1CCCC[C@@H]1C
InChIInChI=1S/C13H26N2O2S/c1-11(2)10-15(13-7-8-13)18(16,17)14-9-5-4-6-12(14)3/h11-13H,4-10H2,1-3H3/t12-/m0/s1
InChIKeyXDURFTSYKCMMGQ-LBPRGKRZSA-N
MW274.43 g/mol
LogP2.23
Rot. Bonds5

About (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide

(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide (PubChem CID 95301387) has the molecular formula C13H26N2O2S and a molecular weight of 274.43 g/mol. Its IUPAC name is (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide.

Molecular Properties

Compound Name(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
PubChem CID95301387
Molecular FormulaC13H26N2O2S
Molecular Weight274.43 g/mol
Exact Mass274.17
IUPAC Name(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
SMILESCC(C)CN(C1CC1)S(=O)(=O)N1CCCC[C@@H]1C
InChIInChI=1S/C13H26N2O2S/c1-11(2)10-15(13-7-8-13)18(16,17)14-9-5-4-6-12(14)3/h11-13H,4-10H2,1-3H3/t12-/m0/s1
InChIKeyXDURFTSYKCMMGQ-LBPRGKRZSA-N
XLogP2.23
TPSA40.62 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.43
LogP ≤ 52.23
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(2R)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide
CID 95301386
N-(3-aminopropyl)-N-cyclopropyl-2-methylpiperidine-1-sulfonamide
CID 43136981
N-(2-bromoethyl)-N-cyclobutyl-2-methylpiperidine-1-sulfonamide
CID 102873505
N-(2-aminoethyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 61348368
N-cyclohexyl-N,2-dimethylpiperidine-1-sulfonamide
CID 128926642
N-(4-aminocyclohexyl)-N,2-dimethylpiperidine-1-sulfonamide
CID 79121076
N-cyclopentyl-N-(2-methylpropyl)methanesulfonamide
CID 58199549
N-(3-chloropropyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 63396547
N-(3-aminopropyl)-2-methyl-N-propan-2-ylpiperidine-1-sulfonamide
CID 43136957
2-methyl-1-propan-2-ylsulfonylpiperidine
CID 59266035
N,2-dimethyl-N-[4-(methylamino)cyclohexyl]piperidine-1-sulfonamide
CID 79123031
N-(2-hydroxyethyl)-N,2-dimethylpiperidine-1-sulfonamide
CID 60961271

Frequently Asked Questions

What is the IUPAC name of (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The IUPAC name of (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide (CID 95301387) is (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide.
What is the SMILES notation for (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The canonical SMILES for (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide is CC(C)CN(C1CC1)S(=O)(=O)N1CCCC[C@@H]1C.
What is the InChIKey of (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
The InChIKey is XDURFTSYKCMMGQ-LBPRGKRZSA-N. The full InChI is InChI=1S/C13H26N2O2S/c1-11(2)10-15(13-7-8-13)18(16,17)14-9-5-4-6-12(14)3/h11-13H,4-10H2,1-3H3/t12-/m0/s1.
What are the key properties of (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide?
(2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide has a molecular weight of 274.43 g/mol, XLogP of 2.23, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-N-cyclopropyl-2-methyl-N-(2-methylpropyl)piperidine-1-sulfonamide is sourced from PubChem (CID 95301387), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).