(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone

C17H23NO2 — CID 155469690

IUPAC(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone
SMILESCC1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1
InChIInChI=1S/C17H23NO2/c1-14-8-11-18(12-9-14)16(19)17(10-5-13-20-17)15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3
InChIKeyZLPGWLWSVSKMNS-UHFFFAOYSA-N
MW273.38 g/mol
LogP2.95
Rot. Bonds2

About (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone

(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone (PubChem CID 155469690) has the molecular formula C17H23NO2 and a molecular weight of 273.38 g/mol. Its IUPAC name is (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone.

Molecular Properties

Compound Name(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone
PubChem CID155469690
Molecular FormulaC17H23NO2
Molecular Weight273.38 g/mol
Exact Mass273.17
IUPAC Name(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone
SMILESCC1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1
InChIInChI=1S/C17H23NO2/c1-14-8-11-18(12-9-14)16(19)17(10-5-13-20-17)15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3
InChIKeyZLPGWLWSVSKMNS-UHFFFAOYSA-N
XLogP2.95
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500273.38
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

Carbiphene
CID 10080
Benzeneacetamide, alpha-ethoxy-N-methyl-N-(2-(methyl(2-phenylethyl)amino)ethyl)-alpha-phenyl-, hydrochloride (1:1)
CID 10079
5-Methyl-3,7-diphenyl-2-oxa-5-azabicyclo[2.2.1]heptan-6-one
CID 13592840
(4-Hydroxy-4-phenyl-piperidin-1-yl)-(tetrahydro-furan-2-yl)-methanone
CID 644736
4-[2-(Diethylamino)ethyl]-2,2-diphenyloxolan-3-one;hydrochloride
CID 49796396
4-Methyl-2-phenyl-9-(2-phenylethyl)-1-oxa-4,9-diazaspiro[5.5]undecan-3-one
CID 162674852
3-Methoxy-3-phenyl-2-piperidinone
CID 137300
2-Furamide, tetrahydro-N,N-diethyl-5-oxo-2-phenyl-
CID 25941
X 100
CID 19153
Benzeneacetamide, alpha-ethoxy-alpha-phenyl-N-(2-(1-pyrrolidinyl)ethyl)-, monohydrochloride
CID 3047310
Lansimide 3
CID 85584195
1-(Ethoxycarbonyl)-3-methoxy-3-phenyl-2-piperidinone
CID 137301

Frequently Asked Questions

What is the IUPAC name of (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone?
The IUPAC name of (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone (CID 155469690) is (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone.
What is the SMILES notation for (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone?
The canonical SMILES for (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone is CC1CCN(C(=O)C2(c3ccccc3)CCCO2)CC1.
What is the InChIKey of (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone?
The InChIKey is ZLPGWLWSVSKMNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23NO2/c1-14-8-11-18(12-9-14)16(19)17(10-5-13-20-17)15-6-3-2-4-7-15/h2-4,6-7,14H,5,8-13H2,1H3.
What are the key properties of (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone?
(4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone has a molecular weight of 273.38 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methylpiperidin-1-yl)-(2-phenyloxolan-2-yl)methanone is sourced from PubChem (CID 155469690), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).