3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine

C12H12FN5 — CID 166313785

IUPAC3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine
SMILESCc1ccn(-c2ccc(N3CC=C(F)C3)nn2)n1
InChIInChI=1S/C12H12FN5/c1-9-4-7-18(16-9)12-3-2-11(14-15-12)17-6-5-10(13)8-17/h2-5,7H,6,8H2,1H3
InChIKeyRQTAYXOYGJPLMX-UHFFFAOYSA-N
MW245.26 g/mol
LogP1.64
Rot. Bonds2

About 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine

3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine (PubChem CID 166313785) has the molecular formula C12H12FN5 and a molecular weight of 245.26 g/mol. Its IUPAC name is 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine.

Molecular Properties

Compound Name3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine
PubChem CID166313785
Molecular FormulaC12H12FN5
Molecular Weight245.26 g/mol
Exact Mass245.11
IUPAC Name3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine
SMILESCc1ccn(-c2ccc(N3CC=C(F)C3)nn2)n1
InChIInChI=1S/C12H12FN5/c1-9-4-7-18(16-9)12-3-2-11(14-15-12)17-6-5-10(13)8-17/h2-5,7H,6,8H2,1H3
InChIKeyRQTAYXOYGJPLMX-UHFFFAOYSA-N
XLogP1.64
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.26
LogP ≤ 51.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

6-fluoro-2-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]-3,4-dihydro-1H-isoquinoline
CID 133422395
3-(3-methylpyrazol-1-yl)-6-[4-(pyrrolidin-1-ylmethyl)piperidin-1-yl]pyridazine
CID 133317757
3-methyl-1-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]pyrrolidin-3-ol
CID 133410717
3-[4-(4-methylphenyl)sulfonylpiperazin-1-yl]-6-(3-methylpyrazol-1-yl)pyridazine
CID 56921399
2-methyl-4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]morpholine
CID 133290493
2-fluoro-4-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]benzonitrile
CID 171334843
2-(4-fluorophenyl)-6-methyl-4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]morpholine
CID 133330395
N,N-dimethyl-4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazine-1-carboxamide
CID 133291071
(3,4-difluorophenyl)-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]methanone
CID 122345832
6-[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]-3-(trifluoromethyl)-[1,2,4]triazolo[4,3-b]pyridazine
CID 154576000
2-methyl-4-[[4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazin-1-yl]methyl]-1,3-thiazole
CID 127292092
N-(2-fluorophenyl)-4-[6-(3-methylpyrazol-1-yl)pyridazin-3-yl]piperazine-1-carboxamide
CID 56920257

Frequently Asked Questions

What is the IUPAC name of 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine?
The IUPAC name of 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine (CID 166313785) is 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine.
What is the SMILES notation for 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine?
The canonical SMILES for 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine is Cc1ccn(-c2ccc(N3CC=C(F)C3)nn2)n1.
What is the InChIKey of 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine?
The InChIKey is RQTAYXOYGJPLMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12FN5/c1-9-4-7-18(16-9)12-3-2-11(14-15-12)17-6-5-10(13)8-17/h2-5,7H,6,8H2,1H3.
What are the key properties of 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine?
3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine has a molecular weight of 245.26 g/mol, XLogP of 1.64, 2 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(3-fluoro-2,5-dihydropyrrol-1-yl)-6-(3-methylpyrazol-1-yl)pyridazine is sourced from PubChem (CID 166313785), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).