(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine

C15H17N3O2 — CID 174291013

IUPAC(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine
SMILESCc1cc(Oc2cccnn2)cc([C@H]2CNCCO2)c1
InChIInChI=1S/C15H17N3O2/c1-11-7-12(14-10-16-5-6-19-14)9-13(8-11)20-15-3-2-4-17-18-15/h2-4,7-9,14,16H,5-6,10H2,1H3/t14-/m1/s1
InChIKeyFEFARTOAPQKUQK-CQSZACIVSA-N
MW271.32 g/mol
LogP2.24
Rot. Bonds3

About (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine

(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine (PubChem CID 174291013) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine.

Molecular Properties

Compound Name(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine
PubChem CID174291013
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine
SMILESCc1cc(Oc2cccnn2)cc([C@H]2CNCCO2)c1
InChIInChI=1S/C15H17N3O2/c1-11-7-12(14-10-16-5-6-19-14)9-13(8-11)20-15-3-2-4-17-18-15/h2-4,7-9,14,16H,5-6,10H2,1H3/t14-/m1/s1
InChIKeyFEFARTOAPQKUQK-CQSZACIVSA-N
XLogP2.24
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 52.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

(2R)-2-(2-methyl-5-pyridazin-3-yloxyphenyl)morpholine
CID 171653174
(2R)-2-(2,3-difluoro-5-pyridazin-3-yloxyphenyl)morpholine
CID 171653313
ethane;(2S)-2-(4-fluoro-3-pyridazin-3-yloxyphenyl)morpholine;molecular hydrogen
CID 171653178
(2R)-2-(3-methylphenyl)morpholine
CID 42182782
2-(3-chloro-5-methylphenyl)morpholine
CID 83703313
2-(3-methylphenyl)morpholine;hydrochloride
CID 71398912
2-(3,5-dimethoxyphenyl)morpholine
CID 53414236
(2R)-2-[3-(1-methylimidazol-4-yl)oxyphenyl]morpholine
CID 171653490
(2R)-2-(3-pyrimidin-4-yloxyphenyl)morpholine
CID 171653353
(2R)-2-(3-pyridin-4-yloxyphenyl)morpholine
CID 171653433
(5S)-5-(3-pyridazin-3-yloxyphenyl)-4-oxa-7-azaspiro[2.5]octane
CID 171653291
2-(4-fluoro-3,5-dimethylphenyl)morpholine
CID 84780671

Frequently Asked Questions

What is the IUPAC name of (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine?
The IUPAC name of (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine (CID 174291013) is (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine.
What is the SMILES notation for (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine?
The canonical SMILES for (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine is Cc1cc(Oc2cccnn2)cc([C@H]2CNCCO2)c1.
What is the InChIKey of (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine?
The InChIKey is FEFARTOAPQKUQK-CQSZACIVSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-11-7-12(14-10-16-5-6-19-14)9-13(8-11)20-15-3-2-4-17-18-15/h2-4,7-9,14,16H,5-6,10H2,1H3/t14-/m1/s1.
What are the key properties of (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine?
(2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine has a molecular weight of 271.32 g/mol, XLogP of 2.24, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2S)-2-(3-methyl-5-pyridazin-3-yloxyphenyl)morpholine is sourced from PubChem (CID 174291013), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).