5,7-difluoro-1,2-dimethoxy-9H-carbazole

C14H11F2NO2 — CID 171715061

IUPAC5,7-difluoro-1,2-dimethoxy-9H-carbazole
SMILESCOc1ccc2c([nH]c3cc(F)cc(F)c32)c1OC
InChIInChI=1S/C14H11F2NO2/c1-18-11-4-3-8-12-9(16)5-7(15)6-10(12)17-13(8)14(11)19-2/h3-6,17H,1-2H3
InChIKeyBRRCASFECOWLCS-UHFFFAOYSA-N
MW263.24 g/mol
LogP3.62
Rot. Bonds2

About 5,7-difluoro-1,2-dimethoxy-9H-carbazole

5,7-difluoro-1,2-dimethoxy-9H-carbazole (PubChem CID 171715061) has the molecular formula C14H11F2NO2 and a molecular weight of 263.24 g/mol. Its IUPAC name is 5,7-difluoro-1,2-dimethoxy-9H-carbazole.

Molecular Properties

Compound Name5,7-difluoro-1,2-dimethoxy-9H-carbazole
PubChem CID171715061
Molecular FormulaC14H11F2NO2
Molecular Weight263.24 g/mol
Exact Mass263.08
IUPAC Name5,7-difluoro-1,2-dimethoxy-9H-carbazole
SMILESCOc1ccc2c([nH]c3cc(F)cc(F)c32)c1OC
InChIInChI=1S/C14H11F2NO2/c1-18-11-4-3-8-12-9(16)5-7(15)6-10(12)17-13(8)14(11)19-2/h3-6,17H,1-2H3
InChIKeyBRRCASFECOWLCS-UHFFFAOYSA-N
XLogP3.62
TPSA34.25 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.24
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 5,7-difluoro-1,2-dimethoxy-9H-carbazole?
The IUPAC name of 5,7-difluoro-1,2-dimethoxy-9H-carbazole (CID 171715061) is 5,7-difluoro-1,2-dimethoxy-9H-carbazole.
What is the SMILES notation for 5,7-difluoro-1,2-dimethoxy-9H-carbazole?
The canonical SMILES for 5,7-difluoro-1,2-dimethoxy-9H-carbazole is COc1ccc2c([nH]c3cc(F)cc(F)c32)c1OC.
What is the InChIKey of 5,7-difluoro-1,2-dimethoxy-9H-carbazole?
The InChIKey is BRRCASFECOWLCS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H11F2NO2/c1-18-11-4-3-8-12-9(16)5-7(15)6-10(12)17-13(8)14(11)19-2/h3-6,17H,1-2H3.
What are the key properties of 5,7-difluoro-1,2-dimethoxy-9H-carbazole?
5,7-difluoro-1,2-dimethoxy-9H-carbazole has a molecular weight of 263.24 g/mol, XLogP of 3.62, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5,7-difluoro-1,2-dimethoxy-9H-carbazole is sourced from PubChem (CID 171715061), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).