N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide

C14H29N3O4S — CID 120896083

IUPACN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide
SMILESCOCC1(CNS(=O)(=O)N2CC(C)OC(C)C2)CCNCC1
InChIInChI=1S/C14H29N3O4S/c1-12-8-17(9-13(2)21-12)22(18,19)16-10-14(11-20-3)4-6-15-7-5-14/h12-13,15-16H,4-11H2,1-3H3
InChIKeyZXXOZJIHBMSKTC-UHFFFAOYSA-N
MW335.47 g/mol
LogP-0.05
Rot. Bonds6

About N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide

N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide (PubChem CID 120896083) has the molecular formula C14H29N3O4S and a molecular weight of 335.47 g/mol. Its IUPAC name is N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide.

Molecular Properties

Compound NameN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide
PubChem CID120896083
Molecular FormulaC14H29N3O4S
Molecular Weight335.47 g/mol
Exact Mass335.19
IUPAC NameN-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide
SMILESCOCC1(CNS(=O)(=O)N2CC(C)OC(C)C2)CCNCC1
InChIInChI=1S/C14H29N3O4S/c1-12-8-17(9-13(2)21-12)22(18,19)16-10-14(11-20-3)4-6-15-7-5-14/h12-13,15-16H,4-11H2,1-3H3
InChIKeyZXXOZJIHBMSKTC-UHFFFAOYSA-N
XLogP-0.05
TPSA79.90 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.47
LogP ≤ 5-0.05
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[[4-(methoxymethyl)piperidin-4-yl]methyl]azepane-1-sulfonamide
CID 120896907
(2R,6S)-4-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine
CID 114042172
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-methylpiperidine-1-sulfonamide;hydrochloride
CID 120896002
2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
CID 120896587
2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide;hydrochloride
CID 120896586
2-(ethylsulfonylamino)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
CID 120896619
2-ethoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]ethanesulfonamide
CID 120896019
4-[[bis(2-methoxyethyl)sulfamoylamino]methyl]-4-(methoxymethyl)piperidine;hydrochloride
CID 120896370
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-methylsulfonylbenzenesulfonamide
CID 120896801
2,6-dimethyl-N-[(1-morpholin-4-ylcyclohexyl)methyl]morpholine-4-sulfonamide
CID 42936471
3,5-difluoro-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]benzenesulfonamide
CID 120896329
2,6-dimethyl-N-(pyrrolidin-3-ylmethyl)morpholine-4-sulfonamide;hydrochloride
CID 120720986

Frequently Asked Questions

What is the IUPAC name of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide?
The IUPAC name of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide (CID 120896083) is N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide.
What is the SMILES notation for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide?
The canonical SMILES for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide is COCC1(CNS(=O)(=O)N2CC(C)OC(C)C2)CCNCC1.
What is the InChIKey of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide?
The InChIKey is ZXXOZJIHBMSKTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O4S/c1-12-8-17(9-13(2)21-12)22(18,19)16-10-14(11-20-3)4-6-15-7-5-14/h12-13,15-16H,4-11H2,1-3H3.
What are the key properties of N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide?
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide has a molecular weight of 335.47 g/mol, XLogP of -0.05, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2,6-dimethylmorpholine-4-sulfonamide is sourced from PubChem (CID 120896083), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).