2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride

C14H30ClN3O4S — CID 120891332

IUPAC2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)CC(=O)NCC1(COC)CCNCC1.Cl
InChIInChI=1S/C14H29N3O4S.ClH/c1-4-17(5-2)22(19,20)10-13(18)16-11-14(12-21-3)6-8-15-9-7-14;/h15H,4-12H2,1-3H3,(H,16,18);1H
InChIKeyKIEAUFHDSZIEQY-UHFFFAOYSA-N
MW371.93 g/mol
LogP0.21
Rot. Bonds9

About 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride

2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride (PubChem CID 120891332) has the molecular formula C14H30ClN3O4S and a molecular weight of 371.93 g/mol. Its IUPAC name is 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride.

Molecular Properties

Compound Name2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride
PubChem CID120891332
Molecular FormulaC14H30ClN3O4S
Molecular Weight371.93 g/mol
Exact Mass371.16
IUPAC Name2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride
SMILESCCN(CC)S(=O)(=O)CC(=O)NCC1(COC)CCNCC1.Cl
InChIInChI=1S/C14H29N3O4S.ClH/c1-4-17(5-2)22(19,20)10-13(18)16-11-14(12-21-3)6-8-15-9-7-14;/h15H,4-12H2,1-3H3,(H,16,18);1H
InChIKeyKIEAUFHDSZIEQY-UHFFFAOYSA-N
XLogP0.21
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500371.93
LogP ≤ 50.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-methoxy-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride
CID 120890024
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-methylbutanamide;hydrochloride
CID 120888970
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-propan-2-yloxypropanamide;hydrochloride
CID 120891438
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3,4,4-trimethylpentanamide
CID 120890413
N-[2-[[4-(methoxymethyl)piperidin-4-yl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide;hydrochloride
CID 120891835
2-(dimethylamino)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-3-methylbutanamide
CID 120891952
3-(2-methoxyethoxy)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]propanamide
CID 120888133
2-[benzenesulfonyl(methyl)amino]-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride
CID 120888886
N-[2-[[4-(methoxymethyl)piperidin-4-yl]methylamino]-2-oxoethyl]-2,2-dimethylpropanamide
CID 120891836
2-cyclobutyl-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide
CID 114280566
N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-2-(4-methylcyclohexyl)acetamide;hydrochloride
CID 120889892
4-(4-ethylphenyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]-4-oxobutanamide;hydrochloride
CID 120891250

Frequently Asked Questions

What is the IUPAC name of 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride?
The IUPAC name of 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride (CID 120891332) is 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride.
What is the SMILES notation for 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride?
The canonical SMILES for 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride is CCN(CC)S(=O)(=O)CC(=O)NCC1(COC)CCNCC1.Cl.
What is the InChIKey of 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride?
The InChIKey is KIEAUFHDSZIEQY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H29N3O4S.ClH/c1-4-17(5-2)22(19,20)10-13(18)16-11-14(12-21-3)6-8-15-9-7-14;/h15H,4-12H2,1-3H3,(H,16,18);1H.
What are the key properties of 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride?
2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride has a molecular weight of 371.93 g/mol, XLogP of 0.21, 9 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(diethylsulfamoyl)-N-[[4-(methoxymethyl)piperidin-4-yl]methyl]acetamide;hydrochloride is sourced from PubChem (CID 120891332), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).