7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole

C16H11FN6 — CID 73426341

IUPAC7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole
SMILESCc1nc2nc[nH]c2cc1-n1c2ccc(F)cc2c2[nH]ncc21
InChIInChI=1S/C16H11FN6/c1-8-13(5-11-16(21-8)19-7-18-11)23-12-3-2-9(17)4-10(12)15-14(23)6-20-22-15/h2-7H,1H3,(H,20,22)(H,18,19,21)
InChIKeyBGVWCIRYUNODHW-UHFFFAOYSA-N
MW306.30 g/mol
LogP3.23
Rot. Bonds1

About 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole

7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole (PubChem CID 73426341) has the molecular formula C16H11FN6 and a molecular weight of 306.30 g/mol. Its IUPAC name is 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole.

Molecular Properties

Compound Name7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole
PubChem CID73426341
Molecular FormulaC16H11FN6
Molecular Weight306.30 g/mol
Exact Mass306.10
IUPAC Name7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole
SMILESCc1nc2nc[nH]c2cc1-n1c2ccc(F)cc2c2[nH]ncc21
InChIInChI=1S/C16H11FN6/c1-8-13(5-11-16(21-8)19-7-18-11)23-12-3-2-9(17)4-10(12)15-14(23)6-20-22-15/h2-7H,1H3,(H,20,22)(H,18,19,21)
InChIKeyBGVWCIRYUNODHW-UHFFFAOYSA-N
XLogP3.23
TPSA75.18 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500306.30
LogP ≤ 53.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole?
The IUPAC name of 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole (CID 73426341) is 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole.
What is the SMILES notation for 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole?
The canonical SMILES for 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole is Cc1nc2nc[nH]c2cc1-n1c2ccc(F)cc2c2[nH]ncc21.
What is the InChIKey of 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole?
The InChIKey is BGVWCIRYUNODHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11FN6/c1-8-13(5-11-16(21-8)19-7-18-11)23-12-3-2-9(17)4-10(12)15-14(23)6-20-22-15/h2-7H,1H3,(H,20,22)(H,18,19,21).
What are the key properties of 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole?
7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole has a molecular weight of 306.30 g/mol, XLogP of 3.23, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-fluoro-4-(5-methyl-1H-imidazo[4,5-b]pyridin-6-yl)-1H-pyrazolo[4,5-b]indole is sourced from PubChem (CID 73426341), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).