1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone

C19H21NO2 — CID 110868603

IUPAC1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C19H21NO2/c21-17-12-7-13-20(14-17)19(22)18(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-11,17-18,21H,7,12-14H2
InChIKeyFPKSQKFAQZGUIR-UHFFFAOYSA-N
MW295.38 g/mol
LogP2.80
Rot. Bonds3

About 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone

1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone (PubChem CID 110868603) has the molecular formula C19H21NO2 and a molecular weight of 295.38 g/mol. Its IUPAC name is 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone.

Molecular Properties

Compound Name1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone
PubChem CID110868603
Molecular FormulaC19H21NO2
Molecular Weight295.38 g/mol
Exact Mass295.16
IUPAC Name1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone
SMILESO=C(C(c1ccccc1)c1ccccc1)N1CCCC(O)C1
InChIInChI=1S/C19H21NO2/c21-17-12-7-13-20(14-17)19(22)18(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-11,17-18,21H,7,12-14H2
InChIKeyFPKSQKFAQZGUIR-UHFFFAOYSA-N
XLogP2.80
TPSA40.54 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.38
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-[(3S)-3-methylpiperidin-1-yl]-2,2-diphenylethanone
CID 1292213
1-[4-(2,2-diphenylacetyl)-1,4-diazepan-1-yl]-2,2-diphenylethanone
CID 5069183
[2-[(3S)-3-hydroxypiperidin-1-yl]-2-oxo-1-phenylethyl]urea
CID 107224574
2,2-diphenyl-1-(3-phenylpyrrolidin-1-yl)ethanone
CID 2910235
2,2-diphenyl-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethanone
CID 113002906
1-[3-(methylaminomethyl)piperidin-1-yl]-2,2-diphenylethanone;hydrochloride
CID 119397483
4-amino-1-(3-hydroxypiperidin-1-yl)-4-phenylbutan-1-one
CID 55204912
1-[4-(cyclohexanecarbonyl)piperazin-1-yl]-2,2-diphenylethanone
CID 108533858
2-cyclopropyl-2-phenyl-1-pyrrolidin-1-ylethanone
CID 110406993
1-(3-hydroxypiperidin-1-yl)-2-phenylmethoxypropan-1-one
CID 43428067
1-[4-(methylamino)piperidin-1-yl]-2,2-diphenylethanone;hydrochloride
CID 119562554
1-(4-methoxypiperidin-1-yl)-2,2-diphenylethanone
CID 110725272

Frequently Asked Questions

What is the IUPAC name of 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone?
The IUPAC name of 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone (CID 110868603) is 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone.
What is the SMILES notation for 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone?
The canonical SMILES for 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone is O=C(C(c1ccccc1)c1ccccc1)N1CCCC(O)C1.
What is the InChIKey of 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone?
The InChIKey is FPKSQKFAQZGUIR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H21NO2/c21-17-12-7-13-20(14-17)19(22)18(15-8-3-1-4-9-15)16-10-5-2-6-11-16/h1-6,8-11,17-18,21H,7,12-14H2.
What are the key properties of 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone?
1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone has a molecular weight of 295.38 g/mol, XLogP of 2.80, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-hydroxypiperidin-1-yl)-2,2-diphenylethanone is sourced from PubChem (CID 110868603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).