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

C14H16O3 — CID 102647006

IUPAC3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)C1=CCCCO1
InChIInChI=1S/C14H16O3/c1-2-16-12-8-4-3-7-11(12)14(15)13-9-5-6-10-17-13/h3-4,7-9H,2,5-6,10H2,1H3
InChIKeyLUNYTKNOEUQSIQ-UHFFFAOYSA-N
MW232.28 g/mol
LogP2.96
Rot. Bonds4

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

3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone (PubChem CID 102647006) has the molecular formula C14H16O3 and a molecular weight of 232.28 g/mol. Its IUPAC name is 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone.

Molecular Properties

Compound Name3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone
PubChem CID102647006
Molecular FormulaC14H16O3
Molecular Weight232.28 g/mol
Exact Mass232.11
IUPAC Name3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone
SMILESCCOc1ccccc1C(=O)C1=CCCCO1
InChIInChI=1S/C14H16O3/c1-2-16-12-8-4-3-7-11(12)14(15)13-9-5-6-10-17-13/h3-4,7-9H,2,5-6,10H2,1H3
InChIKeyLUNYTKNOEUQSIQ-UHFFFAOYSA-N
XLogP2.96
TPSA35.53 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.28
LogP ≤ 52.96
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[2-(2-ethoxybenzoyl)phenyl] hydrogen carbonate
CID 174463979
(2-ethoxyphenyl)-piperidin-1-ylmethanethione
CID 926138
2-ethoxybenzoyl bromide
CID 19426336
2-ethoxybenzoic acid;zinc
CID 172723273
2-ethoxybenzenecarboperoxoic acid
CID 22314606
2-(cyclopropylamino)-1-(2-ethoxyphenyl)ethanone
CID 82102218
potassium;2-ethoxybenzoic acid;hydride
CID 175278645
1-(2-ethoxyphenyl)-2-methylpropan-1-one
CID 62800406
ethane;1-(2-ethoxyphenyl)propan-1-one
CID 145111899
1-[4-(2-ethoxybenzoyl)piperazin-1-yl]ethanone
CID 78795110
(2-ethoxyphenyl)-(1H-pyrrol-2-yl)methanone
CID 63749253
(4-bromo-2,6-difluorophenyl)-(2-ethoxyphenyl)methanone
CID 114971145

Frequently Asked Questions

What is the IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone?
The IUPAC name of 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone (CID 102647006) is 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone.
What is the SMILES notation for 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone?
The canonical SMILES for 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone is CCOc1ccccc1C(=O)C1=CCCCO1.
What is the InChIKey of 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone?
The InChIKey is LUNYTKNOEUQSIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16O3/c1-2-16-12-8-4-3-7-11(12)14(15)13-9-5-6-10-17-13/h3-4,7-9H,2,5-6,10H2,1H3.
What are the key properties of 3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone?
3,4-dihydro-2H-pyran-6-yl-(2-ethoxyphenyl)methanone has a molecular weight of 232.28 g/mol, XLogP of 2.96, 4 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-(2-ethoxyphenyl)methanone is sourced from PubChem (CID 102647006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).