[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol

C15H18FN3O2 — CID 163855596

IUPAC[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol
SMILESOCc1cccc(C2=CC=C(N3CCOCC3)NN2)c1F
InChIInChI=1S/C15H18FN3O2/c16-15-11(10-20)2-1-3-12(15)13-4-5-14(18-17-13)19-6-8-21-9-7-19/h1-5,17-18,20H,6-10H2
InChIKeyOXZWRSZWKKNAEY-UHFFFAOYSA-N
MW291.33 g/mol
LogP0.94
Rot. Bonds3

About [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol

[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol (PubChem CID 163855596) has the molecular formula C15H18FN3O2 and a molecular weight of 291.33 g/mol. Its IUPAC name is [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol.

Molecular Properties

Compound Name[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol
PubChem CID163855596
Molecular FormulaC15H18FN3O2
Molecular Weight291.33 g/mol
Exact Mass291.14
IUPAC Name[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol
SMILESOCc1cccc(C2=CC=C(N3CCOCC3)NN2)c1F
InChIInChI=1S/C15H18FN3O2/c16-15-11(10-20)2-1-3-12(15)13-4-5-14(18-17-13)19-6-8-21-9-7-19/h1-5,17-18,20H,6-10H2
InChIKeyOXZWRSZWKKNAEY-UHFFFAOYSA-N
XLogP0.94
TPSA56.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.33
LogP ≤ 50.94
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol?
The IUPAC name of [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol (CID 163855596) is [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol.
What is the SMILES notation for [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol?
The canonical SMILES for [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol is OCc1cccc(C2=CC=C(N3CCOCC3)NN2)c1F.
What is the InChIKey of [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol?
The InChIKey is OXZWRSZWKKNAEY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18FN3O2/c16-15-11(10-20)2-1-3-12(15)13-4-5-14(18-17-13)19-6-8-21-9-7-19/h1-5,17-18,20H,6-10H2.
What are the key properties of [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol?
[2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol has a molecular weight of 291.33 g/mol, XLogP of 0.94, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [2-fluoro-3-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenyl]methanol is sourced from PubChem (CID 163855596), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).