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

C14H23NO2 — CID 102648348

IUPAC3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)C2=CCCCO2)CCCNC1
InChIInChI=1S/C14H23NO2/c1-2-7-14(8-5-9-15-11-14)13(16)12-6-3-4-10-17-12/h6,15H,2-5,7-11H2,1H3
InChIKeyKSMHBDWEFPKKAK-UHFFFAOYSA-N
MW237.34 g/mol
LogP2.42
Rot. Bonds4

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

3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone (PubChem CID 102648348) has the molecular formula C14H23NO2 and a molecular weight of 237.34 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone
PubChem CID102648348
Molecular FormulaC14H23NO2
Molecular Weight237.34 g/mol
Exact Mass237.17
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone
SMILESCCCC1(C(=O)C2=CCCCO2)CCCNC1
InChIInChI=1S/C14H23NO2/c1-2-7-14(8-5-9-15-11-14)13(16)12-6-3-4-10-17-12/h6,15H,2-5,7-11H2,1H3
InChIKeyKSMHBDWEFPKKAK-UHFFFAOYSA-N
XLogP2.42
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.34
LogP ≤ 52.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3,4-dihydro-2H-pyran-6-yl(piperidin-3-yl)methanone
CID 102648268
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-4-ylethanone
CID 102648312
1-(3,4-dihydro-2H-pyran-6-yl)-3-piperidin-3-ylpropan-1-one
CID 102648321
1-(3,4-dihydro-2H-pyran-6-yl)-3-piperidin-4-ylpropan-1-one
CID 102648325
1-(3,4-dihydro-2H-pyran-6-yl)-2-piperidin-3-ylethanone
CID 102648328
3,4-dihydro-2H-pyran-6-yl-(4-methylpiperidin-4-yl)methanone
CID 102648340
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-propylpyrrolidin-3-yl)methanone
CID 102648351
6-azaspiro[2.5]octan-2-yl(3,4-dihydro-2H-pyran-6-yl)methanone
CID 102648360

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone (CID 102648348) is 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone is CCCC1(C(=O)C2=CCCCO2)CCCNC1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone?
The InChIKey is KSMHBDWEFPKKAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO2/c1-2-7-14(8-5-9-15-11-14)13(16)12-6-3-4-10-17-12/h6,15H,2-5,7-11H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone?
3,4-dihydro-2H-pyran-6-yl-(3-propylpiperidin-3-yl)methanone has a molecular weight of 237.34 g/mol, XLogP of 2.42, 4 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-(3-propylpiperidin-3-yl)methanone is sourced from PubChem (CID 102648348), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).