[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone

C18H23FN2O3 — CID 38491417

IUPAC[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1F
InChIInChI=1S/C18H23FN2O3/c1-13-2-3-15(12-16(13)19)18(23)20-6-4-14(5-7-20)17(22)21-8-10-24-11-9-21/h2-3,12,14H,4-11H2,1H3
InChIKeyKWHRXVFZRWGPQH-UHFFFAOYSA-N
MW334.39 g/mol
LogP1.85
Rot. Bonds2

About [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone

[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone (PubChem CID 38491417) has the molecular formula C18H23FN2O3 and a molecular weight of 334.39 g/mol. Its IUPAC name is [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
PubChem CID38491417
Molecular FormulaC18H23FN2O3
Molecular Weight334.39 g/mol
Exact Mass334.17
IUPAC Name[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
SMILESCc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1F
InChIInChI=1S/C18H23FN2O3/c1-13-2-3-15(12-16(13)19)18(23)20-6-4-14(5-7-20)17(22)21-8-10-24-11-9-21/h2-3,12,14H,4-11H2,1H3
InChIKeyKWHRXVFZRWGPQH-UHFFFAOYSA-N
XLogP1.85
TPSA49.85 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500334.39
LogP ≤ 51.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[1-(2,4-difluorobenzoyl)piperidin-4-yl]-[4-(3-fluoro-4-methylbenzoyl)piperazin-1-yl]methanone
CID 55879784
[4-[[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]methoxy]phenyl]-morpholin-4-ylmethanone
CID 53150447
(4-aminopiperidin-1-yl)-(3-fluoro-4-methylphenyl)methanone;hydrochloride
CID 119374600
morpholin-4-yl-[1-[1-[4-(trifluoromethyl)benzoyl]piperidine-4-carbonyl]piperidin-4-yl]methanone
CID 32651661
[4-(3-fluoro-4-methylbenzoyl)piperazin-1-yl]-piperidin-3-ylmethanone
CID 119282090
[1-(3-chlorobenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38490514
(3-fluoro-4-methylphenyl)-[(3R)-3-hydroxypyrrolidin-1-yl]methanone
CID 66262037
[4-(1-chloroethyl)piperidin-1-yl]-(3-fluoro-4-methylphenyl)methanone
CID 106838877
[1-(2,3-dimethylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone
CID 38490689
(3-fluoro-4-methylphenyl)-[4-(triazol-2-yl)piperidin-1-yl]methanone
CID 121165031
morpholin-4-yl-[1-(4-pentoxybenzoyl)piperidin-4-yl]methanone
CID 112767205
(3-fluoro-4-methylphenyl)-(oxan-4-yl)methanone
CID 63935252

Frequently Asked Questions

What is the IUPAC name of [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone (CID 38491417) is [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone is Cc1ccc(C(=O)N2CCC(C(=O)N3CCOCC3)CC2)cc1F.
What is the InChIKey of [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is KWHRXVFZRWGPQH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23FN2O3/c1-13-2-3-15(12-16(13)19)18(23)20-6-4-14(5-7-20)17(22)21-8-10-24-11-9-21/h2-3,12,14H,4-11H2,1H3.
What are the key properties of [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone?
[1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 334.39 g/mol, XLogP of 1.85, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-fluoro-4-methylbenzoyl)piperidin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 38491417), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).