1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride

C11H23ClN2O2S — CID 120720655

IUPAC1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride
SMILESCC1(CNS(=O)(=O)CC2CC2)CCCNC1.Cl
InChIInChI=1S/C11H22N2O2S.ClH/c1-11(5-2-6-12-8-11)9-13-16(14,15)7-10-3-4-10;/h10,12-13H,2-9H2,1H3;1H
InChIKeyYJJBTOOLAFVNQV-UHFFFAOYSA-N
MW282.84 g/mol
LogP1.13
Rot. Bonds5

About 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride

1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride (PubChem CID 120720655) has the molecular formula C11H23ClN2O2S and a molecular weight of 282.84 g/mol. Its IUPAC name is 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride.

Molecular Properties

Compound Name1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride
PubChem CID120720655
Molecular FormulaC11H23ClN2O2S
Molecular Weight282.84 g/mol
Exact Mass282.12
IUPAC Name1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride
SMILESCC1(CNS(=O)(=O)CC2CC2)CCCNC1.Cl
InChIInChI=1S/C11H22N2O2S.ClH/c1-11(5-2-6-12-8-11)9-13-16(14,15)7-10-3-4-10;/h10,12-13H,2-9H2,1H3;1H
InChIKeyYJJBTOOLAFVNQV-UHFFFAOYSA-N
XLogP1.13
TPSA58.20 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.84
LogP ≤ 51.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-cyclopentyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride
CID 120876267
N-[(3-methylpiperidin-3-yl)methyl]-1-(oxolan-3-yl)methanesulfonamide;hydrochloride
CID 120720798
N-[(3-methylpiperidin-3-yl)methyl]cyclopropanesulfonamide;hydrochloride
CID 120720826
3-[(dimethylsulfamoylamino)methyl]-3-methylpiperidine;hydrochloride
CID 120720873
3-[(diethylsulfamoylamino)methyl]-3-methylpiperidine;hydrochloride
CID 120720872
N-[(1,4-dimethylpiperidin-4-yl)methyl]-1-piperidin-3-ylmethanesulfonamide
CID 107164560
N-[[1-(dimethylamino)cyclopentyl]methyl]-1-piperidin-4-ylmethanesulfonamide
CID 83120440
4-tert-butyl-N-[(3-methylpiperidin-3-yl)methyl]benzenesulfonamide;hydrochloride
CID 120720862
N-[(1-methylsulfanylcyclobutyl)methyl]-1-piperidin-4-ylmethanesulfonamide
CID 114116782
N-[(3-methylpiperidin-3-yl)methyl]pyridine-3-sulfonamide;hydrochloride
CID 120720795
N-[(3-methylpiperidin-3-yl)methyl]-4-(trifluoromethyl)benzenesulfonamide;hydrochloride
CID 120720704
N-[(1-aminocyclohexyl)methyl]-1-cyclohexylmethanesulfonamide;hydrochloride
CID 119958818

Frequently Asked Questions

What is the IUPAC name of 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride?
The IUPAC name of 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride (CID 120720655) is 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride.
What is the SMILES notation for 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride?
The canonical SMILES for 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride is CC1(CNS(=O)(=O)CC2CC2)CCCNC1.Cl.
What is the InChIKey of 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride?
The InChIKey is YJJBTOOLAFVNQV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O2S.ClH/c1-11(5-2-6-12-8-11)9-13-16(14,15)7-10-3-4-10;/h10,12-13H,2-9H2,1H3;1H.
What are the key properties of 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride?
1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride has a molecular weight of 282.84 g/mol, XLogP of 1.13, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-cyclopropyl-N-[(3-methylpiperidin-3-yl)methyl]methanesulfonamide;hydrochloride is sourced from PubChem (CID 120720655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).