3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone

C16H25NO2 — CID 102646946

IUPAC3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone
SMILESO=C(C1=CCCCO1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H25NO2/c18-15(14-8-2-7-13-19-14)16(9-3-4-10-16)17-11-5-1-6-12-17/h8H,1-7,9-13H2
InChIKeyVISGNCLEWOWHMX-UHFFFAOYSA-N
MW263.38 g/mol
LogP3.05
Rot. Bonds3

About 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone

3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone (PubChem CID 102646946) has the molecular formula C16H25NO2 and a molecular weight of 263.38 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone
PubChem CID102646946
Molecular FormulaC16H25NO2
Molecular Weight263.38 g/mol
Exact Mass263.19
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone
SMILESO=C(C1=CCCCO1)C1(N2CCCCC2)CCCC1
InChIInChI=1S/C16H25NO2/c18-15(14-8-2-7-13-19-14)16(9-3-4-10-16)17-11-5-1-6-12-17/h8H,1-7,9-13H2
InChIKeyVISGNCLEWOWHMX-UHFFFAOYSA-N
XLogP3.05
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 53.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3,4-dihydro-2H-pyran-6-yl)-2-methyl-2-piperidin-1-ylbutan-1-one
CID 102646940
3,4-dihydro-2H-pyran-6-yl-[1-(dimethylamino)cyclopentyl]methanone
CID 102646944
3,4-dihydro-2H-pyran-6-yl-(1-pyrrolidin-1-ylcyclopentyl)methanone
CID 102646945
3,4-dihydro-2H-pyran-6-yl-[1-(dimethylamino)cyclohexyl]methanone
CID 102646947
3,4-dihydro-2H-pyran-6-yl-(2-methylpiperidin-2-yl)methanone
CID 102648503
1-(2,3-Dihydrofuran-5-yl)-2-methyl-2-piperidin-1-ylbutan-1-one
CID 102651013
2,3-Dihydrofuran-5-yl-[1-(dimethylamino)cyclopentyl]methanone
CID 102651018
[1-(Diethylamino)cyclopentyl]-(2,3-dihydrofuran-5-yl)methanone
CID 102651019
2,3-Dihydrofuran-5-yl-(1-pyrrolidin-1-ylcyclopentyl)methanone
CID 102651020
2,3-Dihydrofuran-5-yl-(1-morpholin-4-ylcyclopentyl)methanone
CID 102651021
2,3-Dihydrofuran-5-yl-[1-(dimethylamino)cyclohexyl]methanone
CID 102651022
2,3-Dihydrofuran-5-yl-(2-methylpiperidin-2-yl)methanone
CID 102652631

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone (CID 102646946) is 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone is O=C(C1=CCCCO1)C1(N2CCCCC2)CCCC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone?
The InChIKey is VISGNCLEWOWHMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H25NO2/c18-15(14-8-2-7-13-19-14)16(9-3-4-10-16)17-11-5-1-6-12-17/h8H,1-7,9-13H2.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone?
3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone has a molecular weight of 263.38 g/mol, XLogP of 3.05, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-(1-piperidin-1-ylcyclopentyl)methanone is sourced from PubChem (CID 102646946), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).