4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide

C15H27N3O3 — CID 49450341

IUPAC4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide
SMILESCC1CCCCC1N(C)C(=O)CN1CCOC(C(N)=O)C1
InChIInChI=1S/C15H27N3O3/c1-11-5-3-4-6-12(11)17(2)14(19)10-18-7-8-21-13(9-18)15(16)20/h11-13H,3-10H2,1-2H3,(H2,16,20)
InChIKeyLJJBHLPXQYTGOB-UHFFFAOYSA-N
MW297.40 g/mol
LogP0.21
Rot. Bonds4

About 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide

4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide (PubChem CID 49450341) has the molecular formula C15H27N3O3 and a molecular weight of 297.40 g/mol. Its IUPAC name is 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide.

Molecular Properties

Compound Name4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide
PubChem CID49450341
Molecular FormulaC15H27N3O3
Molecular Weight297.40 g/mol
Exact Mass297.21
IUPAC Name4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide
SMILESCC1CCCCC1N(C)C(=O)CN1CCOC(C(N)=O)C1
InChIInChI=1S/C15H27N3O3/c1-11-5-3-4-6-12(11)17(2)14(19)10-18-7-8-21-13(9-18)15(16)20/h11-13H,3-10H2,1-2H3,(H2,16,20)
InChIKeyLJJBHLPXQYTGOB-UHFFFAOYSA-N
XLogP0.21
TPSA75.87 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 50.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-(2,6-dimethylmorpholin-4-yl)-N-(2-methylcyclohexyl)propanamide
CID 45840503
2-[(4aR,7aS)-6-(cyclohexylmethyl)-3-oxo-4a,5,7,7a-tetrahydropyrrolo[3,4-b][1,4]oxazin-4-yl]acetamide
CID 56775361
N-[[(1S,2S)-2-morpholin-4-ylcyclohexyl]methyl]-2-propoxyacetamide
CID 136585182
4-ethyl-N-[2-(trifluoromethyl)cyclohexyl]morpholine-2-carboxamide
CID 71867009
N-(cyclohexylmethyl)morpholine-2-carboxamide
CID 61735908
N-[(2S)-1-cyclohexyl-3-(methylamino)propan-2-yl]morpholine-2-carboxamide
CID 89683257
Ethane;4-(4-methylcyclohexyl)morpholine-2-carboxamide
CID 145052764
N-[2-[(1-amino-5-methyl-4-oxoheptan-3-yl)amino]-2-oxoethyl]morpholine-2-carboxamide
CID 167133855
N-[(3S)-1-amino-3-methyl-1-oxopentan-2-yl]morpholine-2-carboxamide
CID 167218691
N-(2-methylcyclohexyl)-2-morpholin-4-ylacetamide
CID 17634287
(2S)-2-[(2S,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide
CID 27066278
(2R)-2-[(2R,6R)-2,6-dimethylmorpholin-4-yl]-N-[(1R,2S)-2-methylcyclohexyl]propanamide
CID 27066280

Frequently Asked Questions

What is the IUPAC name of 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The IUPAC name of 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide (CID 49450341) is 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide.
What is the SMILES notation for 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The canonical SMILES for 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide is CC1CCCCC1N(C)C(=O)CN1CCOC(C(N)=O)C1.
What is the InChIKey of 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
The InChIKey is LJJBHLPXQYTGOB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H27N3O3/c1-11-5-3-4-6-12(11)17(2)14(19)10-18-7-8-21-13(9-18)15(16)20/h11-13H,3-10H2,1-2H3,(H2,16,20).
What are the key properties of 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide?
4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide has a molecular weight of 297.40 g/mol, XLogP of 0.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[2-[methyl-(2-methylcyclohexyl)amino]-2-oxoethyl]morpholine-2-carboxamide is sourced from PubChem (CID 49450341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).