2-(3-fluorophenyl)-6-methoxy-1H-indene

C16H13FO — CID 18518306

IUPAC2-(3-fluorophenyl)-6-methoxy-1H-indene
SMILESCOc1ccc2c(c1)CC(c1cccc(F)c1)=C2
InChIInChI=1S/C16H13FO/c1-18-16-6-5-12-7-13(8-14(12)10-16)11-3-2-4-15(17)9-11/h2-7,9-10H,8H2,1H3
InChIKeyNPLCBCJZOJNCRN-UHFFFAOYSA-N
MW240.28 g/mol
LogP3.93
Rot. Bonds2

About 2-(3-fluorophenyl)-6-methoxy-1H-indene

2-(3-fluorophenyl)-6-methoxy-1H-indene (PubChem CID 18518306) has the molecular formula C16H13FO and a molecular weight of 240.28 g/mol. Its IUPAC name is 2-(3-fluorophenyl)-6-methoxy-1H-indene.

Molecular Properties

Compound Name2-(3-fluorophenyl)-6-methoxy-1H-indene
PubChem CID18518306
Molecular FormulaC16H13FO
Molecular Weight240.28 g/mol
Exact Mass240.10
IUPAC Name2-(3-fluorophenyl)-6-methoxy-1H-indene
SMILESCOc1ccc2c(c1)CC(c1cccc(F)c1)=C2
InChIInChI=1S/C16H13FO/c1-18-16-6-5-12-7-13(8-14(12)10-16)11-3-2-4-15(17)9-11/h2-7,9-10H,8H2,1H3
InChIKeyNPLCBCJZOJNCRN-UHFFFAOYSA-N
XLogP3.93
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.28
LogP ≤ 53.93
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'stilbene', 'substructure': 'N/A'}

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Related Compounds

2-(3-fluorophenyl)-6-methoxynaphthalene
CID 45156519
1-(3-fluorophenyl)-2-iodo-4-methoxybenzene
CID 172675013
3,7-dimethoxy-1H-naphthalen-2-one
CID 142704894
2,6-bis(3-fluorophenyl)-4-methoxypyridine
CID 46313611
2-(3-fluorophenyl)-5-methoxybenzaldehyde
CID 46314389
3-(3-fluorophenyl)-5-methoxy-1-(methoxymethyl)indazole
CID 174438984
(4S)-2-(6-methoxy-1H-inden-2-yl)-4,5-dihydro-1,3-thiazole-4-carboxylic acid
CID 59859449
3-(2,4-dimethoxyphenyl)-7-methoxy-1,2-dihydronaphthalene
CID 57081453
7-methoxy-3-(trifluoromethyl)-1,2-dihydronaphthalene
CID 132552094
5-[(4-methoxyphenyl)methoxy]-2-phenyl-1H-indene
CID 153469877
2-(6-methoxy-3,4-dihydronaphthalen-2-yl)propan-2-amine
CID 105471629
3-(2-chloro-4-fluoro-3-methoxyphenyl)-7-methoxy-1,2-dihydronaphthalene
CID 54050552

Frequently Asked Questions

What is the IUPAC name of 2-(3-fluorophenyl)-6-methoxy-1H-indene?
The IUPAC name of 2-(3-fluorophenyl)-6-methoxy-1H-indene (CID 18518306) is 2-(3-fluorophenyl)-6-methoxy-1H-indene.
What is the SMILES notation for 2-(3-fluorophenyl)-6-methoxy-1H-indene?
The canonical SMILES for 2-(3-fluorophenyl)-6-methoxy-1H-indene is COc1ccc2c(c1)CC(c1cccc(F)c1)=C2.
What is the InChIKey of 2-(3-fluorophenyl)-6-methoxy-1H-indene?
The InChIKey is NPLCBCJZOJNCRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13FO/c1-18-16-6-5-12-7-13(8-14(12)10-16)11-3-2-4-15(17)9-11/h2-7,9-10H,8H2,1H3.
What are the key properties of 2-(3-fluorophenyl)-6-methoxy-1H-indene?
2-(3-fluorophenyl)-6-methoxy-1H-indene has a molecular weight of 240.28 g/mol, XLogP of 3.93, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(3-fluorophenyl)-6-methoxy-1H-indene is sourced from PubChem (CID 18518306), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).