N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide

C11H25N3O2S — CID 63859486

IUPACN-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide
SMILESCN1CCC(NCC(C)(C)NS(C)(=O)=O)CC1
InChIInChI=1S/C11H25N3O2S/c1-11(2,13-17(4,15)16)9-12-10-5-7-14(3)8-6-10/h10,12-13H,5-9H2,1-4H3
InChIKeyDLHYLBHCEALSBH-UHFFFAOYSA-N
MW263.41 g/mol
LogP-0.00
Rot. Bonds5

About N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide

N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide (PubChem CID 63859486) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide
PubChem CID63859486
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC NameN-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide
SMILESCN1CCC(NCC(C)(C)NS(C)(=O)=O)CC1
InChIInChI=1S/C11H25N3O2S/c1-11(2,13-17(4,15)16)9-12-10-5-7-14(3)8-6-10/h10,12-13H,5-9H2,1-4H3
InChIKeyDLHYLBHCEALSBH-UHFFFAOYSA-N
XLogP-0.00
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 5-0.00
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[1-[(1-ethylpiperidin-4-yl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 63859970
N-[2-methyl-1-[(1-propan-2-ylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide
CID 63859794
N-[2-methyl-1-[(1-methylpiperidin-4-yl)methylamino]propan-2-yl]methanesulfonamide
CID 63859267
N-[2-methyl-1-(spiro[4.5]decan-8-ylamino)propan-2-yl]methanesulfonamide
CID 114817668
N-[2-methyl-1-(thiolan-3-ylamino)propan-2-yl]methanesulfonamide
CID 63859971
N-[1-[(4-ethylcycloheptyl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 65088547
N-[2-methyl-1-[(1-methylpiperidin-3-yl)methylamino]propan-2-yl]methanesulfonamide
CID 63864960
N-[2-methyl-1-[(2-methylcyclohexyl)amino]propan-2-yl]methanesulfonamide
CID 63860145
2-methyl-1-[(1-methylazepan-4-yl)amino]propan-2-ol
CID 65102952
N-[1-[(2-hydroxycycloheptyl)amino]-2-methylpropan-2-yl]methanesulfonamide
CID 63859680
N-(3,3-dimethylbutyl)-1-methylpiperidin-4-amine
CID 60693743
1-methyl-N-(2,2,3,3-tetrafluoropropyl)piperidin-4-amine
CID 103529557

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide?
The IUPAC name of N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide (CID 63859486) is N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide?
The canonical SMILES for N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide is CN1CCC(NCC(C)(C)NS(C)(=O)=O)CC1.
What is the InChIKey of N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide?
The InChIKey is DLHYLBHCEALSBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-11(2,13-17(4,15)16)9-12-10-5-7-14(3)8-6-10/h10,12-13H,5-9H2,1-4H3.
What are the key properties of N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide?
N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide has a molecular weight of 263.41 g/mol, XLogP of -0.00, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-[(1-methylpiperidin-4-yl)amino]propan-2-yl]methanesulfonamide is sourced from PubChem (CID 63859486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).