[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone

C23H23N3O3 — CID 169418355

IUPAC[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone
SMILESCOc1ccc(C)nc1-c1cccc(C(=O)N2CCOC(c3cccnc3)C2)c1
InChIInChI=1S/C23H23N3O3/c1-16-8-9-20(28-2)22(25-16)17-5-3-6-18(13-17)23(27)26-11-12-29-21(15-26)19-7-4-10-24-14-19/h3-10,13-14,21H,11-12,15H2,1-2H3
InChIKeyDBIHBHYUQYOMMN-UHFFFAOYSA-N
MW389.46 g/mol
LogP3.67
Rot. Bonds4

About [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone

[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone (PubChem CID 169418355) has the molecular formula C23H23N3O3 and a molecular weight of 389.46 g/mol. Its IUPAC name is [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone.

Molecular Properties

Compound Name[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone
PubChem CID169418355
Molecular FormulaC23H23N3O3
Molecular Weight389.46 g/mol
Exact Mass389.17
IUPAC Name[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone
SMILESCOc1ccc(C)nc1-c1cccc(C(=O)N2CCOC(c3cccnc3)C2)c1
InChIInChI=1S/C23H23N3O3/c1-16-8-9-20(28-2)22(25-16)17-5-3-6-18(13-17)23(27)26-11-12-29-21(15-26)19-7-4-10-24-14-19/h3-10,13-14,21H,11-12,15H2,1-2H3
InChIKeyDBIHBHYUQYOMMN-UHFFFAOYSA-N
XLogP3.67
TPSA64.55 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500389.46
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

(3,4-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
CID 16894714
[(2R)-2-(2,6-dimethylpyrimidin-4-yl)morpholin-4-yl]-pyridin-3-ylmethanone
CID 124948273
(5-methoxy-1H-indol-2-yl)-(2-pyridin-3-ylmorpholin-4-yl)methanone
CID 91797517
tert-butyl 2-pyridin-3-ylmorpholine-4-carboxylate
CID 16737894
[2-(3,5-dichlorophenyl)morpholin-4-yl]-(3-methoxyphenyl)methanone
CID 121134461
[(2R)-2-(2-bromophenyl)morpholin-4-yl]-pyridin-3-ylmethanone
CID 124571795
[(2R)-2-[4-(dimethylamino)-6-methyl-2-pyridinyl]morpholin-4-yl]-(3-methoxyphenyl)methanone
CID 124953671
(2,5-dimethoxyphenyl)-(2-phenylmorpholin-4-yl)methanone
CID 84544929
(5-methyl-3-phenyl-1,2-oxazol-4-yl)-(2-phenylmorpholin-4-yl)methanone
CID 47021336
(3,5-dimethoxyphenyl)-[2-(4-methoxyphenyl)morpholin-4-yl]methanone
CID 110327180
[1-(2-methoxyphenyl)pyrazol-4-yl]-[(2S)-2-phenylmorpholin-4-yl]methanone
CID 97134508
[2-(3-methoxyphenyl)morpholin-4-yl]-(1-methylbenzimidazol-5-yl)methanone
CID 136517505

Frequently Asked Questions

What is the IUPAC name of [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone?
The IUPAC name of [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone (CID 169418355) is [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone.
What is the SMILES notation for [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone?
The canonical SMILES for [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone is COc1ccc(C)nc1-c1cccc(C(=O)N2CCOC(c3cccnc3)C2)c1.
What is the InChIKey of [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone?
The InChIKey is DBIHBHYUQYOMMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H23N3O3/c1-16-8-9-20(28-2)22(25-16)17-5-3-6-18(13-17)23(27)26-11-12-29-21(15-26)19-7-4-10-24-14-19/h3-10,13-14,21H,11-12,15H2,1-2H3.
What are the key properties of [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone?
[3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone has a molecular weight of 389.46 g/mol, XLogP of 3.67, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [3-(3-methoxy-6-methyl-2-pyridinyl)phenyl]-(2-pyridin-3-ylmorpholin-4-yl)methanone is sourced from PubChem (CID 169418355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).