[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone

C23H28N2O3 — CID 131949336

IUPAC[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone
SMILESCOc1cccc(C2CCCCN2C(=O)c2ccccc2N2CCOCC2)c1
InChIInChI=1S/C23H28N2O3/c1-27-19-8-6-7-18(17-19)21-10-4-5-12-25(21)23(26)20-9-2-3-11-22(20)24-13-15-28-16-14-24/h2-3,6-9,11,17,21H,4-5,10,12-16H2,1H3
InChIKeyZAKLATYCVFWRKJ-UHFFFAOYSA-N
MW380.49 g/mol
LogP3.90
Rot. Bonds4

About [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone

[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone (PubChem CID 131949336) has the molecular formula C23H28N2O3 and a molecular weight of 380.49 g/mol. Its IUPAC name is [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone.

Molecular Properties

Compound Name[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone
PubChem CID131949336
Molecular FormulaC23H28N2O3
Molecular Weight380.49 g/mol
Exact Mass380.21
IUPAC Name[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone
SMILESCOc1cccc(C2CCCCN2C(=O)c2ccccc2N2CCOCC2)c1
InChIInChI=1S/C23H28N2O3/c1-27-19-8-6-7-18(17-19)21-10-4-5-12-25(21)23(26)20-9-2-3-11-22(20)24-13-15-28-16-14-24/h2-3,6-9,11,17,21H,4-5,10,12-16H2,1H3
InChIKeyZAKLATYCVFWRKJ-UHFFFAOYSA-N
XLogP3.90
TPSA42.01 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500380.49
LogP ≤ 53.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-methoxyphenyl)piperidin-1-yl]-morpholin-4-ylmethanone
CID 56898380
(2-methoxyphenyl)-[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 78834014
(2-iodophenyl)-[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 51929591
[(2R)-2-(3-methoxyphenyl)pyrrolidin-1-yl]-(oxan-4-yl)methanone
CID 52556394
bis[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 174863821
[2-(3-methoxyphenyl)azetidin-1-yl]-(oxan-4-yl)methanone
CID 74232483
5-[(2S)-2-(3-methoxyphenyl)piperidine-1-carbonyl]-1,2-oxazol-3-one
CID 99944641
2-(3-methoxyphenyl)-N-(oxan-4-yl)pyrrolidine-1-carboxamide
CID 146123500
furan-2-yl-[2-(3-methoxyphenyl)pyrrolidin-1-yl]methanone
CID 60716835
2-(2-methoxyphenoxy)-1-[(2R)-2-(3-methoxyphenyl)piperidin-1-yl]ethanone
CID 124843390
2-chloro-1-[(2S)-2-(3-methoxyphenyl)pyrrolidin-1-yl]ethanone
CID 51889844
1-[2-[2-(3-methoxyphenyl)piperidin-1-yl]-2-oxoethyl]pyridin-2-one
CID 118781505

Frequently Asked Questions

What is the IUPAC name of [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone?
The IUPAC name of [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone (CID 131949336) is [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone.
What is the SMILES notation for [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone?
The canonical SMILES for [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone is COc1cccc(C2CCCCN2C(=O)c2ccccc2N2CCOCC2)c1.
What is the InChIKey of [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone?
The InChIKey is ZAKLATYCVFWRKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H28N2O3/c1-27-19-8-6-7-18(17-19)21-10-4-5-12-25(21)23(26)20-9-2-3-11-22(20)24-13-15-28-16-14-24/h2-3,6-9,11,17,21H,4-5,10,12-16H2,1H3.
What are the key properties of [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone?
[2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone has a molecular weight of 380.49 g/mol, XLogP of 3.90, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(3-methoxyphenyl)piperidin-1-yl]-(2-morpholin-4-ylphenyl)methanone is sourced from PubChem (CID 131949336), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).