6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole

C14H8F2N4 — CID 73426250

IUPAC6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole
SMILESFc1cc2c3[nH]ncc3n(-c3cccnc3)c2cc1F
InChIInChI=1S/C14H8F2N4/c15-10-4-9-12(5-11(10)16)20(8-2-1-3-17-6-8)13-7-18-19-14(9)13/h1-7H,(H,18,19)
InChIKeyPEWYGTLRHLRPDV-UHFFFAOYSA-N
MW270.24 g/mol
LogP3.18
Rot. Bonds1

About 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole

6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole (PubChem CID 73426250) has the molecular formula C14H8F2N4 and a molecular weight of 270.24 g/mol. Its IUPAC name is 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole.

Molecular Properties

Compound Name6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole
PubChem CID73426250
Molecular FormulaC14H8F2N4
Molecular Weight270.24 g/mol
Exact Mass270.07
IUPAC Name6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole
SMILESFc1cc2c3[nH]ncc3n(-c3cccnc3)c2cc1F
InChIInChI=1S/C14H8F2N4/c15-10-4-9-12(5-11(10)16)20(8-2-1-3-17-6-8)13-7-18-19-14(9)13/h1-7H,(H,18,19)
InChIKeyPEWYGTLRHLRPDV-UHFFFAOYSA-N
XLogP3.18
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.24
LogP ≤ 53.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-pyridin-4-yl-1H-indazole
CID 12412578
3-Methyl-5-(Pyridin-3-Yl)-2h-Pyrazolo[3,4-C]pyridine
CID 71254055
3-[2-Fluoro-5-(trifluoromethyl)phenyl]-1-(pyrazin-2-ylmethyl)indazole
CID 73504556
3-[2-Fluoro-5-(trifluoromethyl)phenyl]-7-methyl-1-(pyrazin-2-ylmethyl)indazole
CID 73504557
3-[5-(Piperidin-1-ylmethyl)-1h-indol-2-yl]-6-(1h-1,2,3-triazol-1-yl)-1h-indazole
CID 135559064
3-[5-(Piperidin-1-ylmethyl)-1h-indol-2-yl]-6-(2h-1,2,3-triazol-2-yl)-1h-indazole
CID 135559067
N-(2-(2,5-difluorophenyl)-5-methylpyridin-4-yl)-1H-pyrazolo[4,3-b]pyridin-7-amine
CID 54671061
5-(1-methylpyrazol-4-yl)-3-(6-piperidin-4-yl-2-pyridinyl)-1H-pyrazolo[3,4-c]pyridine
CID 71253727
(3R)-1-[3-[5-(1-methylpyrazol-4-yl)-1H-pyrazolo[3,4-c]pyridin-3-yl]phenyl]piperidin-3-amine
CID 71254066
5-fluoro-3-[3-[4-[4-fluoro-2-(1H-pyrazol-4-yl)phenyl]piperazin-1-yl]propyl]-1H-indole
CID 155552188
6-[1-methyl-3-(pyridin-4-yl)-1H-pyrazol-4-yl]-1H-indazole
CID 25093328
7-Fluoro-3-[2-fluoro-5-(trifluoromethyl)phenyl]-1-(pyrazin-2-ylmethyl)indazole
CID 134611927

Frequently Asked Questions

What is the IUPAC name of 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole?
The IUPAC name of 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole (CID 73426250) is 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole.
What is the SMILES notation for 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole?
The canonical SMILES for 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole is Fc1cc2c3[nH]ncc3n(-c3cccnc3)c2cc1F.
What is the InChIKey of 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole?
The InChIKey is PEWYGTLRHLRPDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H8F2N4/c15-10-4-9-12(5-11(10)16)20(8-2-1-3-17-6-8)13-7-18-19-14(9)13/h1-7H,(H,18,19).
What are the key properties of 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole?
6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole has a molecular weight of 270.24 g/mol, XLogP of 3.18, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6,7-difluoro-4-pyridin-3-yl-1H-pyrazolo[4,5-b]indole is sourced from PubChem (CID 73426250), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).