[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone

C17H23ClN2O3 — CID 119725542

IUPAC[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCOC(c3ccc(Cl)cc3)C2)CCNCC1
InChIInChI=1S/C17H23ClN2O3/c1-22-17(6-8-19-9-7-17)16(21)20-10-11-23-15(12-20)13-2-4-14(18)5-3-13/h2-5,15,19H,6-12H2,1H3
InChIKeyOUUMZNQPNRQSDZ-UHFFFAOYSA-N
MW338.83 g/mol
LogP2.01
Rot. Bonds3

About [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone

[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone (PubChem CID 119725542) has the molecular formula C17H23ClN2O3 and a molecular weight of 338.83 g/mol. Its IUPAC name is [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone.

Molecular Properties

Compound Name[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone
PubChem CID119725542
Molecular FormulaC17H23ClN2O3
Molecular Weight338.83 g/mol
Exact Mass338.14
IUPAC Name[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone
SMILESCOC1(C(=O)N2CCOC(c3ccc(Cl)cc3)C2)CCNCC1
InChIInChI=1S/C17H23ClN2O3/c1-22-17(6-8-19-9-7-17)16(21)20-10-11-23-15(12-20)13-2-4-14(18)5-3-13/h2-5,15,19H,6-12H2,1H3
InChIKeyOUUMZNQPNRQSDZ-UHFFFAOYSA-N
XLogP2.01
TPSA50.80 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.83
LogP ≤ 52.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-(3-bromophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone
CID 119757095
[2-(2,4-dichloro-5-fluorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone;hydrochloride
CID 119777417
[2-(4-fluorophenyl)morpholin-4-yl]-[4-(methoxymethyl)piperidin-4-yl]methanone
CID 120615830
[2-(4-chlorophenyl)morpholin-4-yl]-pyrrolidin-3-ylmethanone
CID 63005450
[2-(4-chlorophenyl)morpholin-4-yl]-[1-(2-fluorophenyl)cyclopropyl]methanone
CID 110609508
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-hydroxyethanone
CID 56878936
1-[2-(4-chlorophenyl)morpholin-4-yl]butane-1,3-dione
CID 60951251
(4-chloro-2-methoxyphenyl)-[(2R)-2-(4-chlorophenyl)morpholin-4-yl]methanone
CID 95203094
2-(4-chlorophenyl)-1-[2-(4-chlorophenyl)morpholin-4-yl]-2-methylpropan-1-one
CID 55982913
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-ethylbutan-1-one
CID 110327064
1-[(2S)-2-(4-chlorophenyl)morpholin-4-yl]-2-(dimethylamino)ethanone
CID 95205970
1-[2-(4-chlorophenyl)morpholin-4-yl]-2-(1-hydroxycyclopentyl)ethanone
CID 111430703

Frequently Asked Questions

What is the IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone?
The IUPAC name of [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone (CID 119725542) is [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone.
What is the SMILES notation for [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone?
The canonical SMILES for [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone is COC1(C(=O)N2CCOC(c3ccc(Cl)cc3)C2)CCNCC1.
What is the InChIKey of [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone?
The InChIKey is OUUMZNQPNRQSDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23ClN2O3/c1-22-17(6-8-19-9-7-17)16(21)20-10-11-23-15(12-20)13-2-4-14(18)5-3-13/h2-5,15,19H,6-12H2,1H3.
What are the key properties of [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone?
[2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone has a molecular weight of 338.83 g/mol, XLogP of 2.01, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(4-chlorophenyl)morpholin-4-yl]-(4-methoxypiperidin-4-yl)methanone is sourced from PubChem (CID 119725542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).