4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one

C13H18N2O3 — CID 103612536

IUPAC4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one
SMILESCC1CN(C(=O)c2ccn(C)c(=O)c2)C(C)CO1
InChIInChI=1S/C13H18N2O3/c1-9-8-18-10(2)7-15(9)13(17)11-4-5-14(3)12(16)6-11/h4-6,9-10H,7-8H2,1-3H3
InChIKeyGUGUBBCXAVCTTC-UHFFFAOYSA-N
MW250.30 g/mol
LogP0.63
Rot. Bonds1

About 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one

4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one (PubChem CID 103612536) has the molecular formula C13H18N2O3 and a molecular weight of 250.30 g/mol. Its IUPAC name is 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one.

Molecular Properties

Compound Name4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one
PubChem CID103612536
Molecular FormulaC13H18N2O3
Molecular Weight250.30 g/mol
Exact Mass250.13
IUPAC Name4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one
SMILESCC1CN(C(=O)c2ccn(C)c(=O)c2)C(C)CO1
InChIInChI=1S/C13H18N2O3/c1-9-8-18-10(2)7-15(9)13(17)11-4-5-14(3)12(16)6-11/h4-6,9-10H,7-8H2,1-3H3
InChIKeyGUGUBBCXAVCTTC-UHFFFAOYSA-N
XLogP0.63
TPSA51.54 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.30
LogP ≤ 50.63
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

(3-bromophenyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 43420926
(2,5-dimethylmorpholin-4-yl)-(3-iodophenyl)methanone
CID 47163087
(5-bromothiophen-3-yl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 43424620
4-[(3S,4R)-3,4-dihydroxypyrrolidine-1-carbonyl]-1-methylpyridin-2-one
CID 79411364
(3-chloro-4-iodophenyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 103734967
(3-bromo-5-methylphenyl)-(2,5-dimethylmorpholin-4-yl)methanone
CID 104851930
(2,5-dimethylmorpholin-4-yl)-[3-(trifluoromethyl)phenyl]methanone
CID 51077388
[3-(difluoromethoxy)phenyl]-(2,5-dimethylmorpholin-4-yl)methanone
CID 51077390
[(2S,5R)-2,5-dimethylmorpholin-4-yl]-(4-methylsulfonylphenyl)methanone
CID 94050959
(2,5-dimethylmorpholin-4-yl)-pyridin-3-ylmethanone
CID 110727642
3H-benzimidazol-5-yl-(2,5-dimethylmorpholin-4-yl)methanone
CID 43420928
3-[(2R,5S)-2,5-dimethylmorpholine-4-carbonyl]-N-methylbenzenesulfonamide
CID 94051447

Frequently Asked Questions

What is the IUPAC name of 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one?
The IUPAC name of 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one (CID 103612536) is 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one.
What is the SMILES notation for 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one?
The canonical SMILES for 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one is CC1CN(C(=O)c2ccn(C)c(=O)c2)C(C)CO1.
What is the InChIKey of 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one?
The InChIKey is GUGUBBCXAVCTTC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2O3/c1-9-8-18-10(2)7-15(9)13(17)11-4-5-14(3)12(16)6-11/h4-6,9-10H,7-8H2,1-3H3.
What are the key properties of 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one?
4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one has a molecular weight of 250.30 g/mol, XLogP of 0.63, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2,5-dimethylmorpholine-4-carbonyl)-1-methylpyridin-2-one is sourced from PubChem (CID 103612536), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).