1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine

C11H24N2O3S — CID 119961006

IUPAC1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine
SMILESCNCC1CCCN(S(=O)(=O)C(C)COC)C1
InChIInChI=1S/C11H24N2O3S/c1-10(9-16-3)17(14,15)13-6-4-5-11(8-13)7-12-2/h10-12H,4-9H2,1-3H3
InChIKeyBTEAIGXWSYIXIU-UHFFFAOYSA-N
MW264.39 g/mol
LogP0.28
Rot. Bonds6

About 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine

1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine (PubChem CID 119961006) has the molecular formula C11H24N2O3S and a molecular weight of 264.39 g/mol. Its IUPAC name is 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine.

Molecular Properties

Compound Name1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine
PubChem CID119961006
Molecular FormulaC11H24N2O3S
Molecular Weight264.39 g/mol
Exact Mass264.15
IUPAC Name1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine
SMILESCNCC1CCCN(S(=O)(=O)C(C)COC)C1
InChIInChI=1S/C11H24N2O3S/c1-10(9-16-3)17(14,15)13-6-4-5-11(8-13)7-12-2/h10-12H,4-9H2,1-3H3
InChIKeyBTEAIGXWSYIXIU-UHFFFAOYSA-N
XLogP0.28
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.39
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[1-(1-methoxypropan-2-ylsulfonyl)pyrrolidin-3-yl]-N-methylmethanamine;hydrochloride
CID 119977573
1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-amine
CID 119959530
N-(2-methoxypropyl)-3-(methylaminomethyl)piperidine-1-sulfonamide
CID 102701574
N-methyl-1-(1-methylsulfonylpiperidin-3-yl)methanamine;hydrochloride
CID 119961049
(3R)-1-(1-methoxypropan-2-ylsulfonyl)pyrrolidin-3-amine;hydrochloride
CID 119962481
1-(1-cyclopentylsulfonylpiperidin-3-yl)-N-methylmethanamine
CID 115752117
N-[2-(2,2-difluoroethoxy)ethyl]-3-(methylaminomethyl)piperidine-1-sulfonamide
CID 106091913
N-[[1-(1-methoxypropan-2-ylsulfonyl)piperidin-4-yl]methyl]ethanamine;hydrochloride
CID 119990322
N-methyl-1-[1-(2-propan-2-ylpyrazol-3-yl)sulfonylpiperidin-3-yl]methanamine
CID 122560095
3-(methylaminomethyl)-N-[(4-methylcyclohexyl)methyl]piperidine-1-sulfonamide
CID 106062375
N-[1-(diethylamino)propan-2-yl]-3-(methylaminomethyl)piperidine-1-sulfonamide
CID 106052235
N-(2-cyclopentyloxyethyl)-3-(methylaminomethyl)piperidine-1-sulfonamide
CID 106064564

Frequently Asked Questions

What is the IUPAC name of 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine?
The IUPAC name of 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine (CID 119961006) is 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine.
What is the SMILES notation for 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine?
The canonical SMILES for 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine is CNCC1CCCN(S(=O)(=O)C(C)COC)C1.
What is the InChIKey of 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine?
The InChIKey is BTEAIGXWSYIXIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O3S/c1-10(9-16-3)17(14,15)13-6-4-5-11(8-13)7-12-2/h10-12H,4-9H2,1-3H3.
What are the key properties of 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine?
1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine has a molecular weight of 264.39 g/mol, XLogP of 0.28, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-(1-methoxypropan-2-ylsulfonyl)piperidin-3-yl]-N-methylmethanamine is sourced from PubChem (CID 119961006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).