3-(2-methoxyphenyl)-2H-pyran

C12H12O2 — CID 173143980

IUPAC3-(2-methoxyphenyl)-2H-pyran
SMILESCOc1ccccc1C1=CC=COC1
InChIInChI=1S/C12H12O2/c1-13-12-7-3-2-6-11(12)10-5-4-8-14-9-10/h2-8H,9H2,1H3
InChIKeyBDWXMUTUEWVOKC-UHFFFAOYSA-N
MW188.23 g/mol
LogP2.62
Rot. Bonds2

About 3-(2-methoxyphenyl)-2H-pyran

3-(2-methoxyphenyl)-2H-pyran (PubChem CID 173143980) has the molecular formula C12H12O2 and a molecular weight of 188.23 g/mol. Its IUPAC name is 3-(2-methoxyphenyl)-2H-pyran.

Molecular Properties

Compound Name3-(2-methoxyphenyl)-2H-pyran
PubChem CID173143980
Molecular FormulaC12H12O2
Molecular Weight188.23 g/mol
Exact Mass188.08
IUPAC Name3-(2-methoxyphenyl)-2H-pyran
SMILESCOc1ccccc1C1=CC=COC1
InChIInChI=1S/C12H12O2/c1-13-12-7-3-2-6-11(12)10-5-4-8-14-9-10/h2-8H,9H2,1H3
InChIKeyBDWXMUTUEWVOKC-UHFFFAOYSA-N
XLogP2.62
TPSA18.46 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500188.23
LogP ≤ 52.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 3-(2-methoxyphenyl)-2H-pyran?
The IUPAC name of 3-(2-methoxyphenyl)-2H-pyran (CID 173143980) is 3-(2-methoxyphenyl)-2H-pyran.
What is the SMILES notation for 3-(2-methoxyphenyl)-2H-pyran?
The canonical SMILES for 3-(2-methoxyphenyl)-2H-pyran is COc1ccccc1C1=CC=COC1.
What is the InChIKey of 3-(2-methoxyphenyl)-2H-pyran?
The InChIKey is BDWXMUTUEWVOKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12O2/c1-13-12-7-3-2-6-11(12)10-5-4-8-14-9-10/h2-8H,9H2,1H3.
What are the key properties of 3-(2-methoxyphenyl)-2H-pyran?
3-(2-methoxyphenyl)-2H-pyran has a molecular weight of 188.23 g/mol, XLogP of 2.62, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(2-methoxyphenyl)-2H-pyran is sourced from PubChem (CID 173143980), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).