2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine

C18H17NO2 — CID 44569049

IUPAC2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine
SMILESCC1(C)CCc2c(ccc3oc(-c4ccccn4)cc23)O1
InChIInChI=1S/C18H17NO2/c1-18(2)9-8-12-13-11-17(14-5-3-4-10-19-14)20-15(13)6-7-16(12)21-18/h3-7,10-11H,8-9H2,1-2H3
InChIKeyJXYLYSCHVYJKOD-UHFFFAOYSA-N
MW279.34 g/mol
LogP4.60
Rot. Bonds1

About 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine

2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine (PubChem CID 44569049) has the molecular formula C18H17NO2 and a molecular weight of 279.34 g/mol. Its IUPAC name is 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine.

Molecular Properties

Compound Name2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine
PubChem CID44569049
Molecular FormulaC18H17NO2
Molecular Weight279.34 g/mol
Exact Mass279.13
IUPAC Name2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine
SMILESCC1(C)CCc2c(ccc3oc(-c4ccccn4)cc23)O1
InChIInChI=1S/C18H17NO2/c1-18(2)9-8-12-13-11-17(14-5-3-4-10-19-14)20-15(13)6-7-16(12)21-18/h3-7,10-11H,8-9H2,1-2H3
InChIKeyJXYLYSCHVYJKOD-UHFFFAOYSA-N
XLogP4.60
TPSA35.26 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.34
LogP ≤ 54.60
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine?
The IUPAC name of 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine (CID 44569049) is 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine.
What is the SMILES notation for 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine?
The canonical SMILES for 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine is CC1(C)CCc2c(ccc3oc(-c4ccccn4)cc23)O1.
What is the InChIKey of 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine?
The InChIKey is JXYLYSCHVYJKOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17NO2/c1-18(2)9-8-12-13-11-17(14-5-3-4-10-19-14)20-15(13)6-7-16(12)21-18/h3-7,10-11H,8-9H2,1-2H3.
What are the key properties of 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine?
2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine has a molecular weight of 279.34 g/mol, XLogP of 4.60, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(7,7-dimethyl-8,9-dihydrofuro[3,2-f]chromen-2-yl)pyridine is sourced from PubChem (CID 44569049), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).