2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide

C11H24N2O4S — CID 120896587

IUPAC2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
SMILESCOCCS(=O)(=O)NCC1(COC)CCNCC1
InChIInChI=1S/C11H24N2O4S/c1-16-7-8-18(14,15)13-9-11(10-17-2)3-5-12-6-4-11/h12-13H,3-10H2,1-2H3
InChIKeyDJIUAVRODUPBIK-UHFFFAOYSA-N
MW280.39 g/mol
LogP-0.43
Rot. Bonds8

About 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide

2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide (PubChem CID 120896587) has the molecular formula C11H24N2O4S and a molecular weight of 280.39 g/mol. Its IUPAC name is 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide.

Molecular Properties

Compound Name2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
PubChem CID120896587
Molecular FormulaC11H24N2O4S
Molecular Weight280.39 g/mol
Exact Mass280.15
IUPAC Name2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
SMILESCOCCS(=O)(=O)NCC1(COC)CCNCC1
InChIInChI=1S/C11H24N2O4S/c1-16-7-8-18(14,15)13-9-11(10-17-2)3-5-12-6-4-11/h12-13H,3-10H2,1-2H3
InChIKeyDJIUAVRODUPBIK-UHFFFAOYSA-N
XLogP-0.43
TPSA76.66 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500280.39
LogP ≤ 5-0.43
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-(Methoxymethyl)-2,8-diazaspiro[4.5]dec-2-yl propyl sulfone
CID 91922028
2-(Ethylsulfonyl)-4-(methoxymethyl)-2,8-diazaspiro[4.5]decane
CID 110197861
N-(3-methoxypropyl)piperidine-4-sulfonamide
CID 61549677
(4-Methylpiperidin-4-yl)methyl methanesulfonate
CID 135152014
(1-Ethylsulfonyl-4-methylpiperidin-4-yl)methyl methanesulfonate
CID 135173322
Piperidin-4-ylmethyl ethanesulfonate
CID 155295901
N-(3-ethoxypropyl)piperidine-3-sulfonamide
CID 24711512
N-(3-methoxypropyl)piperidine-3-sulfonamide
CID 43153362
N-(3-ethoxypropyl)-1-piperidin-3-ylmethanesulfonamide
CID 54973651
N-(3-ethoxypropyl)-1-piperidin-4-ylmethanesulfonamide
CID 54973652
2-methoxy-N-methyl-N-(2-piperidin-4-ylethyl)ethanesulfonamide
CID 55014440
N-(3-methoxypropyl)-N-methyl-1-piperidin-4-ylmethanesulfonamide
CID 55139547

Frequently Asked Questions

What is the IUPAC name of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide?
The IUPAC name of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide (CID 120896587) is 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide.
What is the SMILES notation for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide?
The canonical SMILES for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide is COCCS(=O)(=O)NCC1(COC)CCNCC1.
What is the InChIKey of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide?
The InChIKey is DJIUAVRODUPBIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O4S/c1-16-7-8-18(14,15)13-9-11(10-17-2)3-5-12-6-4-11/h12-13H,3-10H2,1-2H3.
What are the key properties of 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide?
2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide has a molecular weight of 280.39 g/mol, XLogP of -0.43, 8 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide is sourced from PubChem (CID 120896587), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).