(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine

C15H16FN3O2 — CID 171653264

IUPAC(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine
SMILESCc1cnnc(Oc2ccc(F)c([C@@H]3CNCCO3)c2)c1
InChIInChI=1S/C15H16FN3O2/c1-10-6-15(19-18-8-10)21-11-2-3-13(16)12(7-11)14-9-17-4-5-20-14/h2-3,6-8,14,17H,4-5,9H2,1H3/t14-/m0/s1
InChIKeyCKDCUNBBXIDYFN-AWEZNQCLSA-N
MW289.31 g/mol
LogP2.38
Rot. Bonds3

About (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine

(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine (PubChem CID 171653264) has the molecular formula C15H16FN3O2 and a molecular weight of 289.31 g/mol. Its IUPAC name is (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine.

Molecular Properties

Compound Name(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine
PubChem CID171653264
Molecular FormulaC15H16FN3O2
Molecular Weight289.31 g/mol
Exact Mass289.12
IUPAC Name(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine
SMILESCc1cnnc(Oc2ccc(F)c([C@@H]3CNCCO3)c2)c1
InChIInChI=1S/C15H16FN3O2/c1-10-6-15(19-18-8-10)21-11-2-3-13(16)12(7-11)14-9-17-4-5-20-14/h2-3,6-8,14,17H,4-5,9H2,1H3/t14-/m0/s1
InChIKeyCKDCUNBBXIDYFN-AWEZNQCLSA-N
XLogP2.38
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.31
LogP ≤ 52.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

US11274091, Example 25
CID 146240802
US11274091, Example 28
CID 146240935
N-(p-fluorophenyl)methyl-(S)-3-(3-pyridazinyloxy)-1-piperidinecarboxamide
CID 100640493
5-(4-Cyclohexyloxyphenyl)-3-[4-(difluoromethyl)piperidin-3-yl]oxypyridazine
CID 123791264
(Z)-2-[3,5-difluoro-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-3-iminoprop-1-en-1-amine
CID 129221264
(Z)-2-[3-fluoro-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-3-iminoprop-1-en-1-amine
CID 129221345
(Z)-2-[2,5-difluoro-4-[6-(2,2,6,6-tetramethylpiperidin-4-yl)oxypyridazin-3-yl]phenyl]-3-iminoprop-1-en-1-amine
CID 129221346
tert-butyl N-[(3R)-1-[4-(4-fluorophenyl)-2-pyridazin-3-yloxycyclopentyl]piperidin-3-yl]carbamate
CID 152330315
(3R)-1-[(1S,2S,4R)-4-(4-fluorophenyl)-2-(5-fluoropyridazin-3-yl)oxycyclopentyl]piperidin-3-amine
CID 152696310
[1-[(1R)-4-(4-fluorophenyl)-2-pyridazin-3-yloxycyclopentyl]piperidin-3-yl] N-tert-butylcarbamate
CID 156136614
tert-butyl N-[1-[(1R)-4-(4-fluorophenyl)-2-pyridazin-3-yloxycyclopentyl]piperidin-3-yl]carbamate
CID 156136615
piperidin-3-yl N-[4-(4-fluorophenyl)-2-(5-fluoropyridazin-3-yl)oxycyclopentyl]carbamate
CID 156136617

Frequently Asked Questions

What is the IUPAC name of (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine?
The IUPAC name of (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine (CID 171653264) is (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine.
What is the SMILES notation for (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine?
The canonical SMILES for (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine is Cc1cnnc(Oc2ccc(F)c([C@@H]3CNCCO3)c2)c1.
What is the InChIKey of (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine?
The InChIKey is CKDCUNBBXIDYFN-AWEZNQCLSA-N. The full InChI is InChI=1S/C15H16FN3O2/c1-10-6-15(19-18-8-10)21-11-2-3-13(16)12(7-11)14-9-17-4-5-20-14/h2-3,6-8,14,17H,4-5,9H2,1H3/t14-/m0/s1.
What are the key properties of (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine?
(2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine has a molecular weight of 289.31 g/mol, XLogP of 2.38, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2R)-2-[2-fluoro-5-(5-methylpyridazin-3-yl)oxyphenyl]morpholine is sourced from PubChem (CID 171653264), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).