7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine

C21H16FN9 — CID 167366692

IUPAC7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
SMILESCc1nc(-c2[nH]ncc2-c2ccc3ncc(-c4nnn5c4NCC5)cc3n2)ccc1F
InChIInChI=1S/C21H16FN9/c1-11-14(22)2-3-17(26-11)20-13(10-25-28-20)15-4-5-16-18(27-15)8-12(9-24-16)19-21-23-6-7-31(21)30-29-19/h2-5,8-10,23H,6-7H2,1H3,(H,25,28)
InChIKeyYNFQHJQOIVCUQU-UHFFFAOYSA-N
MW413.42 g/mol
LogP3.21
Rot. Bonds3

About 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine

7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine (PubChem CID 167366692) has the molecular formula C21H16FN9 and a molecular weight of 413.42 g/mol. Its IUPAC name is 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine.

Molecular Properties

Compound Name7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
PubChem CID167366692
Molecular FormulaC21H16FN9
Molecular Weight413.42 g/mol
Exact Mass413.15
IUPAC Name7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
SMILESCc1nc(-c2[nH]ncc2-c2ccc3ncc(-c4nnn5c4NCC5)cc3n2)ccc1F
InChIInChI=1S/C21H16FN9/c1-11-14(22)2-3-17(26-11)20-13(10-25-28-20)15-4-5-16-18(27-15)8-12(9-24-16)19-21-23-6-7-31(21)30-29-19/h2-5,8-10,23H,6-7H2,1H3,(H,25,28)
InChIKeyYNFQHJQOIVCUQU-UHFFFAOYSA-N
XLogP3.21
TPSA110.09 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds3
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500413.42
LogP ≤ 53.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

Analyze 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine with MolForge

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Related Compounds

7-(2,3-dihydro-1H-imidazo[1,2-c]imidazol-5-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine
CID 167366674
2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(2,4,5,6-tetrahydropyrrolo[2,3-c]pyrazol-3-yl)-1,5-naphthyridine
CID 167367152
2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(5,6,7,8-tetrahydroimidazo[1,2-a]pyrazin-2-yl)-1,5-naphthyridine
CID 167366510
2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-[3-(trifluoromethyl)-5,6,7,8-tetrahydroimidazo[1,5-a]pyrazin-1-yl]-1,5-naphthyridine
CID 167366634
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyrazin-3-yl)-1,5-naphthyridine
CID 167366496
2-[6-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]-1,4,5,6,7,8-hexahydroimidazo[4,5-d]azepine
CID 167367039
6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-3-(4,5,6,7-tetrahydrotriazolo[1,5-a]pyrazin-3-yl)quinoline
CID 167367186
2-[5-(3,4-difluorophenyl)-1H-pyrazol-4-yl]-7-(4-propan-2-ylpiperazin-1-yl)-1,5-naphthyridine
CID 146661723
6-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-N-[2-(4-propan-2-ylpiperazin-1-yl)ethyl]quinolin-3-amine
CID 167367223
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-piperidin-1-yl-1,5-naphthyridine
CID 167367153
2-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-7-(1H-pyrrol-2-yl)-1,5-naphthyridine
CID 167367044
6-[6-[5-(6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridin-3-yl]pyrazin-2-amine
CID 167366670

Frequently Asked Questions

What is the IUPAC name of 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine?
The IUPAC name of 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine (CID 167366692) is 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine.
What is the SMILES notation for 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine?
The canonical SMILES for 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine is Cc1nc(-c2[nH]ncc2-c2ccc3ncc(-c4nnn5c4NCC5)cc3n2)ccc1F.
What is the InChIKey of 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine?
The InChIKey is YNFQHJQOIVCUQU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H16FN9/c1-11-14(22)2-3-17(26-11)20-13(10-25-28-20)15-4-5-16-18(27-15)8-12(9-24-16)19-21-23-6-7-31(21)30-29-19/h2-5,8-10,23H,6-7H2,1H3,(H,25,28).
What are the key properties of 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine?
7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine has a molecular weight of 413.42 g/mol, XLogP of 3.21, 3 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(5,6-dihydro-4H-imidazo[1,2-c]triazol-3-yl)-2-[5-(5-fluoro-6-methyl-2-pyridinyl)-1H-pyrazol-4-yl]-1,5-naphthyridine is sourced from PubChem (CID 167366692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).