N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide

C11H22N2O4S2 — CID 82843062

IUPACN-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)CS(=O)(=O)N(CC1CCNCC1)C1CC1
InChIInChI=1S/C11H22N2O4S2/c1-18(14,15)9-19(16,17)13(11-2-3-11)8-10-4-6-12-7-5-10/h10-12H,2-9H2,1H3
InChIKeyANSSNYVCGIMQKN-UHFFFAOYSA-N
MW310.44 g/mol
LogP-0.22
Rot. Bonds6

About N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide

N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide (PubChem CID 82843062) has the molecular formula C11H22N2O4S2 and a molecular weight of 310.44 g/mol. Its IUPAC name is N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide
PubChem CID82843062
Molecular FormulaC11H22N2O4S2
Molecular Weight310.44 g/mol
Exact Mass310.10
IUPAC NameN-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide
SMILESCS(=O)(=O)CS(=O)(=O)N(CC1CCNCC1)C1CC1
InChIInChI=1S/C11H22N2O4S2/c1-18(14,15)9-19(16,17)13(11-2-3-11)8-10-4-6-12-7-5-10/h10-12H,2-9H2,1H3
InChIKeyANSSNYVCGIMQKN-UHFFFAOYSA-N
XLogP-0.22
TPSA83.55 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500310.44
LogP ≤ 5-0.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-methyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide
CID 82842676
1-methylsulfonyl-N-(piperidin-4-ylmethyl)-N-propan-2-ylmethanesulfonamide
CID 82842964
1-methylsulfonyl-N-(piperidin-4-ylmethyl)-N-propylmethanesulfonamide
CID 82842868
methyl 3-[cyclopropyl(piperidin-4-ylmethyl)sulfamoyl]propanoate
CID 79717402
N-(dipropylsulfamoyl)-N-(piperidin-4-ylmethyl)cyclopropanamine
CID 79702592
N-cyclopropyl-N-(cyclopropylmethyl)ethanesulfonamide
CID 63103163
1-cyano-N-cyclopropyl-N-(piperidin-4-ylmethyl)ethanesulfonamide
CID 79717240
2-[cyclopropyl(piperidin-4-ylmethyl)sulfamoyl]propanoic acid
CID 79717086
4-[cyclopropylmethyl(sulfamoyl)amino]piperidine
CID 167049531
N-cyclopropyl-N-(piperidin-4-ylmethyl)benzenesulfonamide
CID 79717324
N-cyclopropyl-1,1-dioxo-N-(piperidin-4-ylmethyl)thiolane-3-sulfonamide
CID 79701122
N-ethyl-N-(piperidin-4-ylmethyl)methanesulfonamide
CID 79717314

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide?
The IUPAC name of N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide (CID 82843062) is N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide.
What is the SMILES notation for N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide?
The canonical SMILES for N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide is CS(=O)(=O)CS(=O)(=O)N(CC1CCNCC1)C1CC1.
What is the InChIKey of N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide?
The InChIKey is ANSSNYVCGIMQKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S2/c1-18(14,15)9-19(16,17)13(11-2-3-11)8-10-4-6-12-7-5-10/h10-12H,2-9H2,1H3.
What are the key properties of N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide?
N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide has a molecular weight of 310.44 g/mol, XLogP of -0.22, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-1-methylsulfonyl-N-(piperidin-4-ylmethyl)methanesulfonamide is sourced from PubChem (CID 82843062), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).