2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol

C14H17N3O2 — CID 145481211

IUPAC2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol
SMILESOc1ccccc1C1=CC=C(N2CCOCC2)NN1
InChIInChI=1S/C14H17N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(16-15-12)17-7-9-19-10-8-17/h1-6,15-16,18H,7-10H2
InChIKeyKYKBEMQBVBDBAJ-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.01
Rot. Bonds2

About 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol

2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol (PubChem CID 145481211) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol.

Molecular Properties

Compound Name2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol
PubChem CID145481211
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol
SMILESOc1ccccc1C1=CC=C(N2CCOCC2)NN1
InChIInChI=1S/C14H17N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(16-15-12)17-7-9-19-10-8-17/h1-6,15-16,18H,7-10H2
InChIKeyKYKBEMQBVBDBAJ-UHFFFAOYSA-N
XLogP1.01
TPSA56.76 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.01
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol?
The IUPAC name of 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol (CID 145481211) is 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol.
What is the SMILES notation for 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol?
The canonical SMILES for 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol is Oc1ccccc1C1=CC=C(N2CCOCC2)NN1.
What is the InChIKey of 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol?
The InChIKey is KYKBEMQBVBDBAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c18-13-4-2-1-3-11(13)12-5-6-14(16-15-12)17-7-9-19-10-8-17/h1-6,15-16,18H,7-10H2.
What are the key properties of 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol?
2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol has a molecular weight of 259.31 g/mol, XLogP of 1.01, 2 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-morpholin-4-yl-1,2-dihydropyridazin-3-yl)phenol is sourced from PubChem (CID 145481211), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).