6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole

C16H11FN2 — CID 139680665

IUPAC6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole
SMILESCC1=c2c(cc3c(c2C)N=c2ccc(F)cc2=3)N=C1
InChIInChI=1S/C16H11FN2/c1-8-7-18-14-6-12-11-5-10(17)3-4-13(11)19-16(12)9(2)15(8)14/h3-7H,1-2H3
InChIKeyNPJKZIWWXYBUHT-UHFFFAOYSA-N
MW250.28 g/mol
LogP2.57
Rot. Bonds

About 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole

6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole (PubChem CID 139680665) has the molecular formula C16H11FN2 and a molecular weight of 250.28 g/mol. Its IUPAC name is 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole.

Molecular Properties

Compound Name6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole
PubChem CID139680665
Molecular FormulaC16H11FN2
Molecular Weight250.28 g/mol
Exact Mass250.09
IUPAC Name6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole
SMILESCC1=c2c(cc3c(c2C)N=c2ccc(F)cc2=3)N=C1
InChIInChI=1S/C16H11FN2/c1-8-7-18-14-6-12-11-5-10(17)3-4-13(11)19-16(12)9(2)15(8)14/h3-7H,1-2H3
InChIKeyNPJKZIWWXYBUHT-UHFFFAOYSA-N
XLogP2.57
TPSA24.72 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.28
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole?
The IUPAC name of 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole (CID 139680665) is 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole.
What is the SMILES notation for 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole?
The canonical SMILES for 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole is CC1=c2c(cc3c(c2C)N=c2ccc(F)cc2=3)N=C1.
What is the InChIKey of 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole?
The InChIKey is NPJKZIWWXYBUHT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN2/c1-8-7-18-14-6-12-11-5-10(17)3-4-13(11)19-16(12)9(2)15(8)14/h3-7H,1-2H3.
What are the key properties of 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole?
6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole has a molecular weight of 250.28 g/mol, XLogP of 2.57, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 6-fluoro-1,10-dimethylpyrrolo[3,2-b]carbazole is sourced from PubChem (CID 139680665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).