1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone

C14H19NO2 — CID 126758606

IUPAC1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone
SMILESCOC1(c2ccccc2)CCN(C(C)=O)CC1
InChIInChI=1S/C14H19NO2/c1-12(16)15-10-8-14(17-2,9-11-15)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3
InChIKeyBJGNGGCWNZEJGQ-UHFFFAOYSA-N
MW233.31 g/mol
LogP2.17
Rot. Bonds2

About 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone

1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone (PubChem CID 126758606) has the molecular formula C14H19NO2 and a molecular weight of 233.31 g/mol. Its IUPAC name is 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone.

Molecular Properties

Compound Name1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone
PubChem CID126758606
Molecular FormulaC14H19NO2
Molecular Weight233.31 g/mol
Exact Mass233.14
IUPAC Name1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone
SMILESCOC1(c2ccccc2)CCN(C(C)=O)CC1
InChIInChI=1S/C14H19NO2/c1-12(16)15-10-8-14(17-2,9-11-15)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3
InChIKeyBJGNGGCWNZEJGQ-UHFFFAOYSA-N
XLogP2.17
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.31
LogP ≤ 52.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-methoxy-1-nitroso-4-phenylpiperidine
CID 119087555
1-[4-(4-nitrophenoxy)-4-phenylpiperidin-1-yl]ethanone
CID 14649986
(3S)-3-(4-methoxy-4-phenylpiperidine-1-carbonyl)piperidine-1-carboxamide
CID 97123681
1-[2-(4-methoxy-4-phenylpiperidin-1-yl)-2-oxoethyl]-5-methylpyrrolidin-2-one
CID 72861394
1-[4-phenyl-4-[3-(trifluoromethyl)phenoxy]piperidin-1-yl]ethanone
CID 14649985
1-benzyl-4-methoxy-4-phenylpiperidine
CID 170986894
4-methoxy-4-phenylcyclohexan-1-one
CID 22492992
(4-methoxy-4-phenylpiperidin-1-yl)-[2-[(3S)-pyrrolidin-3-yl]phenyl]methanone
CID 95714009
(4-methoxy-4-phenylpiperidin-1-yl)-[4-(1H-1,2,4-triazol-5-yl)phenyl]methanone
CID 162636120
2-[(1,1-dioxothiolan-3-yl)-methylamino]-1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone
CID 163315452
[1-ethyl-3-(2-methylpropyl)pyrazol-5-yl]-(4-methoxy-4-phenylpiperidin-1-yl)methanone
CID 162636784
4-methoxy-4-phenyloxane
CID 21049814

Frequently Asked Questions

What is the IUPAC name of 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone?
The IUPAC name of 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone (CID 126758606) is 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone.
What is the SMILES notation for 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone?
The canonical SMILES for 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone is COC1(c2ccccc2)CCN(C(C)=O)CC1.
What is the InChIKey of 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone?
The InChIKey is BJGNGGCWNZEJGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO2/c1-12(16)15-10-8-14(17-2,9-11-15)13-6-4-3-5-7-13/h3-7H,8-11H2,1-2H3.
What are the key properties of 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone?
1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone has a molecular weight of 233.31 g/mol, XLogP of 2.17, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxy-4-phenylpiperidin-1-yl)ethanone is sourced from PubChem (CID 126758606), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).