3-(5-methoxy-1H-inden-2-yl)pyridine

C15H13NO — CID 6540048

IUPAC3-(5-methoxy-1H-inden-2-yl)pyridine
SMILESCOc1ccc2c(c1)C=C(c1cccnc1)C2
InChIInChI=1S/C15H13NO/c1-17-15-5-4-11-7-13(8-14(11)9-15)12-3-2-6-16-10-12/h2-6,8-10H,7H2,1H3
InChIKeyKPJYOCDWGFDTFR-UHFFFAOYSA-N
MW223.28 g/mol
LogP3.19
Rot. Bonds2

About 3-(5-methoxy-1H-inden-2-yl)pyridine

3-(5-methoxy-1H-inden-2-yl)pyridine (PubChem CID 6540048) has the molecular formula C15H13NO and a molecular weight of 223.28 g/mol. Its IUPAC name is 3-(5-methoxy-1H-inden-2-yl)pyridine.

Molecular Properties

Compound Name3-(5-methoxy-1H-inden-2-yl)pyridine
PubChem CID6540048
Molecular FormulaC15H13NO
Molecular Weight223.28 g/mol
Exact Mass223.10
IUPAC Name3-(5-methoxy-1H-inden-2-yl)pyridine
SMILESCOc1ccc2c(c1)C=C(c1cccnc1)C2
InChIInChI=1S/C15H13NO/c1-17-15-5-4-11-7-13(8-14(11)9-15)12-3-2-6-16-10-12/h2-6,8-10H,7H2,1H3
InChIKeyKPJYOCDWGFDTFR-UHFFFAOYSA-N
XLogP3.19
TPSA22.12 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500223.28
LogP ≤ 53.19
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 12616525
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1-(6-methoxy-3-pyridin-3-yl-1H-inden-2-yl)-N,N-dimethylmethanamine
CID 11522580
4-methoxy-2-pyridin-3-ylaniline
CID 71445761
2-(3-fluorophenyl)-6-methoxy-1H-indene
CID 18518306
3-methoxy-5-(5-pyridin-3-ylthiophen-2-yl)pyridine
CID 177401684
4-(4-methoxyphenyl)-2-methyl-6-pyridin-3-ylpyrimidine
CID 177437339
2-(3-methoxyphenyl)-5-pyridin-3-yl-1,3,4-oxadiazole
CID 25054364
3-(2,6-dimethoxy-4-pyridin-3-ylnaphthalen-1-yl)pyridine
CID 169050278
3-(2,5-dimethoxy-4-pyridin-3-ylphenyl)pyridine
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6-methoxy-3-methyl-1,2-dihydroisoquinoline
CID 69142122

Frequently Asked Questions

What is the IUPAC name of 3-(5-methoxy-1H-inden-2-yl)pyridine?
The IUPAC name of 3-(5-methoxy-1H-inden-2-yl)pyridine (CID 6540048) is 3-(5-methoxy-1H-inden-2-yl)pyridine.
What is the SMILES notation for 3-(5-methoxy-1H-inden-2-yl)pyridine?
The canonical SMILES for 3-(5-methoxy-1H-inden-2-yl)pyridine is COc1ccc2c(c1)C=C(c1cccnc1)C2.
What is the InChIKey of 3-(5-methoxy-1H-inden-2-yl)pyridine?
The InChIKey is KPJYOCDWGFDTFR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H13NO/c1-17-15-5-4-11-7-13(8-14(11)9-15)12-3-2-6-16-10-12/h2-6,8-10H,7H2,1H3.
What are the key properties of 3-(5-methoxy-1H-inden-2-yl)pyridine?
3-(5-methoxy-1H-inden-2-yl)pyridine has a molecular weight of 223.28 g/mol, XLogP of 3.19, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methoxy-1H-inden-2-yl)pyridine is sourced from PubChem (CID 6540048), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).