N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide

C12H24N2O2S — CID 55001507

IUPACN-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide
SMILESCC(C)CN(C1CC1)S(=O)(=O)CC1CCCN1
InChIInChI=1S/C12H24N2O2S/c1-10(2)8-14(12-5-6-12)17(15,16)9-11-4-3-7-13-11/h10-13H,3-9H2,1-2H3
InChIKeyWOHNQIBMUAWIGR-UHFFFAOYSA-N
MW260.40 g/mol
LogP1.19
Rot. Bonds6

About N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide

N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide (PubChem CID 55001507) has the molecular formula C12H24N2O2S and a molecular weight of 260.40 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide
PubChem CID55001507
Molecular FormulaC12H24N2O2S
Molecular Weight260.40 g/mol
Exact Mass260.16
IUPAC NameN-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide
SMILESCC(C)CN(C1CC1)S(=O)(=O)CC1CCCN1
InChIInChI=1S/C12H24N2O2S/c1-10(2)8-14(12-5-6-12)17(15,16)9-11-4-3-7-13-11/h10-13H,3-9H2,1-2H3
InChIKeyWOHNQIBMUAWIGR-UHFFFAOYSA-N
XLogP1.19
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.40
LogP ≤ 51.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-bis(3-methylbutyl)-1-piperidin-2-ylmethanesulfonamide
CID 107870369
2-(3-methylbutylsulfonylmethyl)pyrrolidine
CID 115071189
N-cycloheptyl-N-methyl-1-pyrrolidin-2-ylmethanesulfonamide
CID 54972486
1-cyclohexyl-N-cyclopropyl-N-(piperidin-2-ylmethyl)methanesulfonamide
CID 106630084
N,N-bis(2-methylpropyl)-2-piperidin-2-ylethanesulfonamide
CID 61378664
N-cyclopropyl-N-(2-methylpropyl)piperidine-3-sulfonamide
CID 55001459
2-methyl-N-(2-methylpropyl)-N-(pyrrolidin-2-ylmethyl)propan-1-amine
CID 61378673
2-(2-methylpropylsulfonylmethyl)piperidine
CID 71777978
(2S)-2-(2-methylpropylsulfonylmethyl)piperidine
CID 97301330
N-cyclopropyl-1-(oxolan-2-yl)-N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 106599566
(2R)-2-(methylsulfonylmethyl)pyrrolidine;hydrochloride
CID 155971117
N-ethyl-2-methyl-N-(pyrrolidin-2-ylmethyl)propane-1-sulfonamide
CID 106608119

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The IUPAC name of N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide (CID 55001507) is N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide.
What is the SMILES notation for N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The canonical SMILES for N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide is CC(C)CN(C1CC1)S(=O)(=O)CC1CCCN1.
What is the InChIKey of N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide?
The InChIKey is WOHNQIBMUAWIGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O2S/c1-10(2)8-14(12-5-6-12)17(15,16)9-11-4-3-7-13-11/h10-13H,3-9H2,1-2H3.
What are the key properties of N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide?
N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide has a molecular weight of 260.40 g/mol, XLogP of 1.19, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methylpropyl)-1-pyrrolidin-2-ylmethanesulfonamide is sourced from PubChem (CID 55001507), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).