N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride

C11H23ClN2O4S — CID 119786370

IUPACN-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride
SMILESCCS(=O)(=O)CC(C)N(C)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C11H22N2O4S.ClH/c1-4-18(15,16)8-9(2)13(3)11(14)10-7-12-5-6-17-10;/h9-10,12H,4-8H2,1-3H3;1H
InChIKeyANOPMAQNFGOAIC-UHFFFAOYSA-N
MW314.84 g/mol
LogP-0.32
Rot. Bonds5

About N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride

N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride (PubChem CID 119786370) has the molecular formula C11H23ClN2O4S and a molecular weight of 314.84 g/mol. Its IUPAC name is N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride.

Molecular Properties

Compound NameN-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride
PubChem CID119786370
Molecular FormulaC11H23ClN2O4S
Molecular Weight314.84 g/mol
Exact Mass314.11
IUPAC NameN-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride
SMILESCCS(=O)(=O)CC(C)N(C)C(=O)C1CNCCO1.Cl
InChIInChI=1S/C11H22N2O4S.ClH/c1-4-18(15,16)8-9(2)13(3)11(14)10-7-12-5-6-17-10;/h9-10,12H,4-8H2,1-3H3;1H
InChIKeyANOPMAQNFGOAIC-UHFFFAOYSA-N
XLogP-0.32
TPSA75.71 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.84
LogP ≤ 5-0.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2S)-N-methyl-N-propan-2-ylmorpholine-2-carboxamide;hydrochloride
CID 131067526
N-(4-ethylsulfanylbutan-2-yl)-N-methylmorpholine-2-carboxamide
CID 119817492
N,N-dimethylmorpholine-2-carboxamide;hydrochloride
CID 71298970
N-(2-hydroxypropyl)-N-methylmorpholine-2-carboxamide
CID 62333960
N,N-dimethylmorpholine-2-carboxamide;ethane
CID 144883589
N-(2,2-difluoroethyl)-N-methylmorpholine-2-carboxamide;hydrochloride
CID 119752897
N-[2-[methyl(propan-2-yl)amino]ethyl]morpholine-2-carboxamide
CID 62641152
N-cyclopropyl-N-(3-methylbutyl)morpholine-2-carboxamide;hydrochloride
CID 119728977
N-butyl-N-ethylmorpholine-2-carboxamide;hydrochloride
CID 119676463
N-[1-(1-benzofuran-2-yl)ethyl]-N-methylmorpholine-2-carboxamide;hydrochloride
CID 119705084
N-benzyl-N-butan-2-ylmorpholine-2-carboxamide;hydrochloride
CID 119688848
N-methyl-N-[1-(4-methylsulfinylphenyl)ethyl]morpholine-2-carboxamide
CID 119818195

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride?
The IUPAC name of N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride (CID 119786370) is N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride.
What is the SMILES notation for N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride?
The canonical SMILES for N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride is CCS(=O)(=O)CC(C)N(C)C(=O)C1CNCCO1.Cl.
What is the InChIKey of N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride?
The InChIKey is ANOPMAQNFGOAIC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N2O4S.ClH/c1-4-18(15,16)8-9(2)13(3)11(14)10-7-12-5-6-17-10;/h9-10,12H,4-8H2,1-3H3;1H.
What are the key properties of N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride?
N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride has a molecular weight of 314.84 g/mol, XLogP of -0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylsulfonylpropan-2-yl)-N-methylmorpholine-2-carboxamide;hydrochloride is sourced from PubChem (CID 119786370), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).