(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one

C18H19NO2 — CID 122401830

IUPAC(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one
SMILESCOc1ccc(N2CC[C@@H](c3ccccc3)CC2=O)cc1
InChIInChI=1S/C18H19NO2/c1-21-17-9-7-16(8-10-17)19-12-11-15(13-18(19)20)14-5-3-2-4-6-14/h2-10,15H,11-13H2,1H3/t15-/m1/s1
InChIKeyZCBBHYAMKZVAFW-OAHLLOKOSA-N
MW281.36 g/mol
LogP3.61
Rot. Bonds3

About (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one

(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one (PubChem CID 122401830) has the molecular formula C18H19NO2 and a molecular weight of 281.36 g/mol. Its IUPAC name is (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one.

Molecular Properties

Compound Name(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one
PubChem CID122401830
Molecular FormulaC18H19NO2
Molecular Weight281.36 g/mol
Exact Mass281.14
IUPAC Name(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one
SMILESCOc1ccc(N2CC[C@@H](c3ccccc3)CC2=O)cc1
InChIInChI=1S/C18H19NO2/c1-21-17-9-7-16(8-10-17)19-12-11-15(13-18(19)20)14-5-3-2-4-6-14/h2-10,15H,11-13H2,1H3/t15-/m1/s1
InChIKeyZCBBHYAMKZVAFW-OAHLLOKOSA-N
XLogP3.61
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.61
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

(3S)-1-(4-methoxyphenyl)-3-(4-phenylpiperidin-1-yl)pyrrolidine-2,5-dione
CID 7358060
(4S)-1-(4-methoxyphenyl)-4-phenylazetidin-2-one
CID 10354907
1,5-bis(4-methoxyphenyl)piperidin-2-one
CID 153340032
(4aS,9aR)-2-[(4-methoxyphenyl)methyl]-7-phenyl-1,3,4,4a,5,8,9,9a-octahydropyrido[3,4-d]azepin-6-one
CID 26742684
1,4-bis(4-methoxyphenyl)piperazine-2,5-dione
CID 585094
(3aR,4R,7R,7aR)-2-(4-methoxyphenyl)-4,7-diphenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 124775903
4-(3-cyclopentyloxy-4-methoxyphenyl)-1-(4-methoxyphenyl)pyrrolidin-2-one
CID 10619838
(4R)-1-(4-methoxyphenyl)-4-(4-nitrophenyl)pyrrolidin-2-one
CID 11034304
1-(4-methoxybenzoyl)-4-phenylpyrrolidin-2-one
CID 3537198
2-(4-methoxyphenyl)-5-phenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 3344966
(3aS,5R,7aR)-2-(4-methoxyphenyl)-5-phenyl-3a,4,5,6,7,7a-hexahydroisoindole-1,3-dione
CID 92543020
4-(1-benzylbenzimidazol-2-yl)-1-(4-methoxyphenyl)pyrrolidin-2-one
CID 4242932

Frequently Asked Questions

What is the IUPAC name of (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one?
The IUPAC name of (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one (CID 122401830) is (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one.
What is the SMILES notation for (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one?
The canonical SMILES for (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one is COc1ccc(N2CC[C@@H](c3ccccc3)CC2=O)cc1.
What is the InChIKey of (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one?
The InChIKey is ZCBBHYAMKZVAFW-OAHLLOKOSA-N. The full InChI is InChI=1S/C18H19NO2/c1-21-17-9-7-16(8-10-17)19-12-11-15(13-18(19)20)14-5-3-2-4-6-14/h2-10,15H,11-13H2,1H3/t15-/m1/s1.
What are the key properties of (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one?
(4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one has a molecular weight of 281.36 g/mol, XLogP of 3.61, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4R)-1-(4-methoxyphenyl)-4-phenylpiperidin-2-one is sourced from PubChem (CID 122401830), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).