6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one

C19H22N2O3 — CID 126425423

IUPAC6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one
SMILESCCC[C@H]1COCCN1C(=O)c1cccc(-c2cccc(=O)[nH]2)c1
InChIInChI=1S/C19H22N2O3/c1-2-5-16-13-24-11-10-21(16)19(23)15-7-3-6-14(12-15)17-8-4-9-18(22)20-17/h3-4,6-9,12,16H,2,5,10-11,13H2,1H3,(H,20,22)/t16-/m0/s1
InChIKeyYAIUERSGLOMCQI-INIZCTEOSA-N
MW326.40 g/mol
LogP2.68
Rot. Bonds4

About 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one

6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one (PubChem CID 126425423) has the molecular formula C19H22N2O3 and a molecular weight of 326.40 g/mol. Its IUPAC name is 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one.

Molecular Properties

Compound Name6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one
PubChem CID126425423
Molecular FormulaC19H22N2O3
Molecular Weight326.40 g/mol
Exact Mass326.16
IUPAC Name6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one
SMILESCCC[C@H]1COCCN1C(=O)c1cccc(-c2cccc(=O)[nH]2)c1
InChIInChI=1S/C19H22N2O3/c1-2-5-16-13-24-11-10-21(16)19(23)15-7-3-6-14(12-15)17-8-4-9-18(22)20-17/h3-4,6-9,12,16H,2,5,10-11,13H2,1H3,(H,20,22)/t16-/m0/s1
InChIKeyYAIUERSGLOMCQI-INIZCTEOSA-N
XLogP2.68
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.40
LogP ≤ 52.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

[3-(4-chlorophenyl)phenyl]-[(3R)-3-propylmorpholin-4-yl]methanone
CID 125164657
[3-(2-methoxyphenyl)phenyl]-(3-propylmorpholin-4-yl)methanone
CID 91777127
6-(3-ethylmorpholine-4-carbonyl)-1H-pyridin-2-one
CID 107262017
3-[3-[(3S)-3-ethylmorpholine-4-carbonyl]phenyl]chromen-2-one
CID 171908503
[3-(hydroxymethyl)morpholin-4-yl]-[3-(2-methyl-4-pyridinyl)phenyl]methanone
CID 118793260
[3-(2-fluorophenyl)phenyl]-[3-(hydroxymethyl)morpholin-4-yl]methanone
CID 91790121
(3-methylmorpholin-4-yl)-(3-phenylphenyl)methanone
CID 110292242
2-[4-(6-oxo-1H-pyridine-2-carbonyl)morpholin-3-yl]acetic acid
CID 114040095
3-(3-ethylmorpholine-4-carbonyl)-N'-hydroxybenzenecarboximidamide
CID 43613610
[(3R)-3-ethylmorpholin-4-yl]-[3-(propan-2-ylamino)phenyl]methanone
CID 96536811
2-[(3R)-4-(2-oxo-6-phenyl-1H-pyridine-3-carbonyl)morpholin-3-yl]acetic acid
CID 95711057
[3-(hydroxymethyl)morpholin-4-yl]-[3-(1,3-thiazol-2-yl)phenyl]methanone
CID 118760713

Frequently Asked Questions

What is the IUPAC name of 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one?
The IUPAC name of 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one (CID 126425423) is 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one.
What is the SMILES notation for 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one?
The canonical SMILES for 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one is CCC[C@H]1COCCN1C(=O)c1cccc(-c2cccc(=O)[nH]2)c1.
What is the InChIKey of 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one?
The InChIKey is YAIUERSGLOMCQI-INIZCTEOSA-N. The full InChI is InChI=1S/C19H22N2O3/c1-2-5-16-13-24-11-10-21(16)19(23)15-7-3-6-14(12-15)17-8-4-9-18(22)20-17/h3-4,6-9,12,16H,2,5,10-11,13H2,1H3,(H,20,22)/t16-/m0/s1.
What are the key properties of 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one?
6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one has a molecular weight of 326.40 g/mol, XLogP of 2.68, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-[(3S)-3-propylmorpholine-4-carbonyl]phenyl]-1H-pyridin-2-one is sourced from PubChem (CID 126425423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).