2-fluoro-5,10-dimethylideneazecine

C11H10FN — CID 131966070

IUPAC2-fluoro-5,10-dimethylideneazecine
SMILESC=c1ccccc(=C)nc(F)cc1
InChIInChI=1S/C11H10FN/c1-9-5-3-4-6-10(2)13-11(12)8-7-9/h3-8H,1-2H2/b5-3+,6-4-,8-7-,13-11-
InChIKeyNHHGKYQHNIOGEK-GINYZEKZSA-N
MW175.21 g/mol
LogP1.17
Rot. Bonds

About 2-fluoro-5,10-dimethylideneazecine

2-fluoro-5,10-dimethylideneazecine (PubChem CID 131966070) has the molecular formula C11H10FN and a molecular weight of 175.21 g/mol. Its IUPAC name is 2-fluoro-5,10-dimethylideneazecine.

Molecular Properties

Compound Name2-fluoro-5,10-dimethylideneazecine
PubChem CID131966070
Molecular FormulaC11H10FN
Molecular Weight175.21 g/mol
Exact Mass175.08
IUPAC Name2-fluoro-5,10-dimethylideneazecine
SMILESC=c1ccccc(=C)nc(F)cc1
InChIInChI=1S/C11H10FN/c1-9-5-3-4-6-10(2)13-11(12)8-7-9/h3-8H,1-2H2/b5-3+,6-4-,8-7-,13-11-
InChIKeyNHHGKYQHNIOGEK-GINYZEKZSA-N
XLogP1.17
TPSA12.89 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.21
LogP ≤ 51.17
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 2-fluoro-5,10-dimethylideneazecine?
The IUPAC name of 2-fluoro-5,10-dimethylideneazecine (CID 131966070) is 2-fluoro-5,10-dimethylideneazecine.
What is the SMILES notation for 2-fluoro-5,10-dimethylideneazecine?
The canonical SMILES for 2-fluoro-5,10-dimethylideneazecine is C=c1ccccc(=C)nc(F)cc1.
What is the InChIKey of 2-fluoro-5,10-dimethylideneazecine?
The InChIKey is NHHGKYQHNIOGEK-GINYZEKZSA-N. The full InChI is InChI=1S/C11H10FN/c1-9-5-3-4-6-10(2)13-11(12)8-7-9/h3-8H,1-2H2/b5-3+,6-4-,8-7-,13-11-.
What are the key properties of 2-fluoro-5,10-dimethylideneazecine?
2-fluoro-5,10-dimethylideneazecine has a molecular weight of 175.21 g/mol, XLogP of 1.17, 0 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-fluoro-5,10-dimethylideneazecine is sourced from PubChem (CID 131966070), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).