N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide

C11H25N3O2S — CID 106633955

IUPACN-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide
SMILESCC(C)(CNCC1CCCCN1)NS(C)(=O)=O
InChIInChI=1S/C11H25N3O2S/c1-11(2,14-17(3,15)16)9-12-8-10-6-4-5-7-13-10/h10,12-14H,4-9H2,1-3H3
InChIKeyMMFXZPVLCXNTJC-UHFFFAOYSA-N
MW263.41 g/mol
LogP0.05
Rot. Bonds6

About N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide

N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide (PubChem CID 106633955) has the molecular formula C11H25N3O2S and a molecular weight of 263.41 g/mol. Its IUPAC name is N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide.

Molecular Properties

Compound NameN-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide
PubChem CID106633955
Molecular FormulaC11H25N3O2S
Molecular Weight263.41 g/mol
Exact Mass263.17
IUPAC NameN-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide
SMILESCC(C)(CNCC1CCCCN1)NS(C)(=O)=O
InChIInChI=1S/C11H25N3O2S/c1-11(2,14-17(3,15)16)9-12-8-10-6-4-5-7-13-10/h10,12-14H,4-9H2,1-3H3
InChIKeyMMFXZPVLCXNTJC-UHFFFAOYSA-N
XLogP0.05
TPSA70.23 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.41
LogP ≤ 50.05
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2,2-dimethyl-N-(piperidin-2-ylmethyl)propan-1-amine
CID 61167867
2-methyl-2-methylsulfanyl-N-(piperidin-2-ylmethyl)propan-1-amine
CID 106634399
2-methylsulfonyl-N-(piperidin-2-ylmethyl)ethanamine
CID 84686147
2-cyclobutyl-2-methyl-N-(piperidin-2-ylmethyl)propan-1-amine
CID 115209472
2,2-dimethyl-N-(piperidin-2-ylmethyl)pentan-1-amine
CID 115209445
N-(pyrrolidin-2-ylmethyl)methanesulfonamide
CID 59418450
N-(piperidin-2-ylmethyl)ethanamine
CID 11970483
N-[2-methyl-1-[(1-methylpiperidin-4-yl)methylamino]propan-2-yl]methanesulfonamide
CID 63859267
N-methyl-2-(piperidin-2-ylmethylamino)ethanesulfonamide
CID 106333681
1-cyclobutyl-N-(piperidin-2-ylmethyl)methanamine
CID 106633110
2-(piperidin-2-ylmethylamino)ethanesulfonamide
CID 106633143
2-methyl-N-(piperidin-2-ylmethyl)-2-pyridin-4-ylpropan-1-amine
CID 115209463

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide?
The IUPAC name of N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide (CID 106633955) is N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide.
What is the SMILES notation for N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide?
The canonical SMILES for N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide is CC(C)(CNCC1CCCCN1)NS(C)(=O)=O.
What is the InChIKey of N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide?
The InChIKey is MMFXZPVLCXNTJC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25N3O2S/c1-11(2,14-17(3,15)16)9-12-8-10-6-4-5-7-13-10/h10,12-14H,4-9H2,1-3H3.
What are the key properties of N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide?
N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide has a molecular weight of 263.41 g/mol, XLogP of 0.05, 6 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-(piperidin-2-ylmethylamino)propan-2-yl]methanesulfonamide is sourced from PubChem (CID 106633955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).