(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone

C16H22N2O2 — CID 66240855

IUPAC(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone
SMILESNC1COCC1C(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C16H22N2O2/c17-15-11-20-10-14(15)16(19)18-8-6-13(7-9-18)12-4-2-1-3-5-12/h1-5,13-15H,6-11,17H2
InChIKeyLBSQSYHMGVPMCM-UHFFFAOYSA-N
MW274.36 g/mol
LogP1.37
Rot. Bonds2

About (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone

(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone (PubChem CID 66240855) has the molecular formula C16H22N2O2 and a molecular weight of 274.36 g/mol. Its IUPAC name is (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone
PubChem CID66240855
Molecular FormulaC16H22N2O2
Molecular Weight274.36 g/mol
Exact Mass274.17
IUPAC Name(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone
SMILESNC1COCC1C(=O)N1CCC(c2ccccc2)CC1
InChIInChI=1S/C16H22N2O2/c17-15-11-20-10-14(15)16(19)18-8-6-13(7-9-18)12-4-2-1-3-5-12/h1-5,13-15H,6-11,17H2
InChIKeyLBSQSYHMGVPMCM-UHFFFAOYSA-N
XLogP1.37
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.36
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(4-aminooxolan-3-yl)-(3-phenylpyrrolidin-1-yl)methanone
CID 66236076
[(1R,5S)-3-oxabicyclo[3.1.0]hexan-6-yl]-(4-phenylpiperidin-1-yl)methanone
CID 136583837
(4-aminooxolan-3-yl)-[4-(2-fluorophenyl)piperazin-1-yl]methanone
CID 66240445
(4-aminooxolan-3-yl)-[4-(2-methylphenyl)piperazin-1-yl]methanone
CID 66238290
morpholin-4-yl-(4-phenylpiperidin-1-yl)methanone
CID 67308530
(4-amino-3-methyloxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone
CID 66250245
4-phenylpiperidine-1-carbothioic S-acid
CID 174725157
1-(4-aminooxolane-3-carbonyl)-N-methylpiperidine-4-carboxamide
CID 66240807
(4-aminooxolan-3-yl)-(4-propylpiperidin-1-yl)methanone
CID 66236078
(1-methylpiperidin-4-yl)-(4-phenylpiperidin-1-yl)methanone
CID 91806523
(4-aminooxolan-3-yl)-[4-(cyclopropylmethyl)piperazin-1-yl]methanone
CID 66237050
(2-hydroxycyclopentyl)-(3-phenylpyrrolidin-1-yl)methanone
CID 110014366

Frequently Asked Questions

What is the IUPAC name of (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone?
The IUPAC name of (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone (CID 66240855) is (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone.
What is the SMILES notation for (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone?
The canonical SMILES for (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone is NC1COCC1C(=O)N1CCC(c2ccccc2)CC1.
What is the InChIKey of (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone?
The InChIKey is LBSQSYHMGVPMCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H22N2O2/c17-15-11-20-10-14(15)16(19)18-8-6-13(7-9-18)12-4-2-1-3-5-12/h1-5,13-15H,6-11,17H2.
What are the key properties of (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone?
(4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone has a molecular weight of 274.36 g/mol, XLogP of 1.37, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminooxolan-3-yl)-(4-phenylpiperidin-1-yl)methanone is sourced from PubChem (CID 66240855), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).