3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone

C12H19NO2 — CID 102648340

IUPAC3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone
SMILESCC1(C(=O)C2=CCCCO2)CCNCC1
InChIInChI=1S/C12H19NO2/c1-12(5-7-13-8-6-12)11(14)10-4-2-3-9-15-10/h4,13H,2-3,5-9H2,1H3
InChIKeyVPLCKWSAIAIWEQ-UHFFFAOYSA-N
MW209.29 g/mol
LogP1.64
Rot. Bonds2

About 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone

3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone (PubChem CID 102648340) has the molecular formula C12H19NO2 and a molecular weight of 209.29 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone
PubChem CID102648340
Molecular FormulaC12H19NO2
Molecular Weight209.29 g/mol
Exact Mass209.14
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone
SMILESCC1(C(=O)C2=CCCCO2)CCNCC1
InChIInChI=1S/C12H19NO2/c1-12(5-7-13-8-6-12)11(14)10-4-2-3-9-15-10/h4,13H,2-3,5-9H2,1H3
InChIKeyVPLCKWSAIAIWEQ-UHFFFAOYSA-N
XLogP1.64
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.29
LogP ≤ 51.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-pyran-6-yl(piperidin-4-yl)methanone
CID 102648266
1-(3,4-dihydro-2H-pyran-6-yl)-4-(methylamino)butan-1-one
CID 102648296
1-(3,4-dihydro-2H-pyran-6-yl)-4-(propan-2-ylamino)butan-1-one
CID 102648305
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-4-ylethanone
CID 102648312
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-3-ylethanone
CID 102648328
3,4-dihydro-2H-pyran-6-yl-(4-ethylpiperidin-4-yl)methanone
CID 102648342
3,4-dihydro-2H-pyran-6-yl-(3-ethylpiperidin-3-yl)methanone
CID 102648344
3,4-dihydro-2H-pyran-6-yl-(4-propylpiperidin-4-yl)methanone
CID 102648346
3,4-dihydro-2H-pyran-6-yl-(3-methylpiperidin-3-yl)methanone
CID 102648347
3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone
CID 102648348
3,4-dihydro-2H-pyran-6-yl-(3-methylpyrrolidin-3-yl)methanone
CID 102648349
3,4-dihydro-2H-pyran-6-yl-(3-ethylpyrrolidin-3-yl)methanone
CID 102648350

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone (CID 102648340) is 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone is CC1(C(=O)C2=CCCCO2)CCNCC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone?
The InChIKey is VPLCKWSAIAIWEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO2/c1-12(5-7-13-8-6-12)11(14)10-4-2-3-9-15-10/h4,13H,2-3,5-9H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone?
3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone has a molecular weight of 209.29 g/mol, XLogP of 1.64, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone is sourced from PubChem (CID 102648340), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).