N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide

C10H20N2O2S — CID 115640207

IUPACN-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide
SMILESCSCC(C)N(C)C(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2S/c1-9(8-15-3)11(2)10(13)12-4-6-14-7-5-12/h9H,4-8H2,1-3H3
InChIKeyKZZCJMFEEDLPHP-UHFFFAOYSA-N
MW232.35 g/mol
LogP1.12
Rot. Bonds3

About N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide

N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide (PubChem CID 115640207) has the molecular formula C10H20N2O2S and a molecular weight of 232.35 g/mol. Its IUPAC name is N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide.

Molecular Properties

Compound NameN-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide
PubChem CID115640207
Molecular FormulaC10H20N2O2S
Molecular Weight232.35 g/mol
Exact Mass232.12
IUPAC NameN-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide
SMILESCSCC(C)N(C)C(=O)N1CCOCC1
InChIInChI=1S/C10H20N2O2S/c1-9(8-15-3)11(2)10(13)12-4-6-14-7-5-12/h9H,4-8H2,1-3H3
InChIKeyKZZCJMFEEDLPHP-UHFFFAOYSA-N
XLogP1.12
TPSA32.78 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.35
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-N-[(3S)-2-methyl-4-oxopentan-3-yl]morpholine-4-carboxamide
CID 178173065
N-methyl-N-(1-methylsulfanylpropan-2-yl)acetamide
CID 112692053
4-carbamothioyl-N-methyl-N-(1-methylsulfanylpropan-2-yl)oxane-4-carboxamide
CID 112659666
2-[4-aminobutan-2-yl(methyl)amino]-1-morpholin-4-ylpropan-1-one
CID 63225345
(2R)-2-hydroxy-1-morpholin-4-ylbutan-1-one
CID 69457105
N-ethynyl-N-methylmorpholine-4-carboxamide
CID 70106574
2-[methyl(2-methylsulfanylethyl)amino]-1-morpholin-4-ylethanone
CID 78815658
N-(4-methylsulfanylbutan-2-yl)morpholine-4-carboxamide
CID 115640219
N-ethyl-N-(2-ethylbutyl)morpholine-4-carboxamide
CID 115589059
2-methyl-2-[1-[methyl(1-methylsulfanylpropan-2-yl)carbamoyl]piperidin-3-yl]propanoic acid
CID 115986673
N-methyl-N-(1-thiophen-2-ylethyl)morpholine-4-carboxamide
CID 115575769
N-[1-(4-chlorophenyl)ethyl]-N-methylmorpholine-4-carboxamide
CID 115579428

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide?
The IUPAC name of N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide (CID 115640207) is N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide.
What is the SMILES notation for N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide?
The canonical SMILES for N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide is CSCC(C)N(C)C(=O)N1CCOCC1.
What is the InChIKey of N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide?
The InChIKey is KZZCJMFEEDLPHP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S/c1-9(8-15-3)11(2)10(13)12-4-6-14-7-5-12/h9H,4-8H2,1-3H3.
What are the key properties of N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide?
N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide has a molecular weight of 232.35 g/mol, XLogP of 1.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-methylsulfanylpropan-2-yl)morpholine-4-carboxamide is sourced from PubChem (CID 115640207), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).