2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol

C15H18N4O — CID 137045907

IUPAC2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol
SMILESNc1nnc(-c2ccccc2O)cc1N1CCCCC1
InChIInChI=1S/C15H18N4O/c16-15-13(19-8-4-1-5-9-19)10-12(17-18-15)11-6-2-3-7-14(11)20/h2-3,6-7,10,20H,1,4-5,8-9H2,(H2,16,18)
InChIKeyRJVQZTLPHCJXNB-UHFFFAOYSA-N
MW270.34 g/mol
LogP2.42
Rot. Bonds2

About 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol

2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol (PubChem CID 137045907) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol.

Molecular Properties

Compound Name2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol
PubChem CID137045907
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol
SMILESNc1nnc(-c2ccccc2O)cc1N1CCCCC1
InChIInChI=1S/C15H18N4O/c16-15-13(19-8-4-1-5-9-19)10-12(17-18-15)11-6-2-3-7-14(11)20/h2-3,6-7,10,20H,1,4-5,8-9H2,(H2,16,18)
InChIKeyRJVQZTLPHCJXNB-UHFFFAOYSA-N
XLogP2.42
TPSA75.27 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 52.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

Gne-064
CID 137029447
Sgc-smarca-brdviii
CID 137045929
SMARCA-BD ligand 1 for Protac
CID 137045944
2-[6-azanyl-5-[(3~{R})-3-phenoxypiperidin-1-yl]pyridazin-3-yl]phenol
CID 154573640
1-[3-Azanyl-6-(2-hydroxyphenyl)pyridazin-4-yl]piperidin-4-ol
CID 154573641
2-{6-[2-(8-Aza-bicyclo[3.2.1]oct-8-yl)-ethylamino]-4-methyl-pyridazin-3-yl}-phenol
CID 135525247
5-Fluoro-2-{6-[methyl-(2,2,6,6-tetramethyl-piperidin-4-yl)-amino]-pyridazin-3-yl}-phenol
CID 136253018
US10308614, Example 45
CID 137029366
2-(6-Amino-5-(pyrrolidin-
CID 137029371
US10308614, Example 6
CID 137029398
US10308614, Example 8
CID 137029438
(3S,4S)-1-[3-amino-6-(2-hydroxyphenyl)pyridazin-4-yl]piperidine-3,4-diol
CID 162645940

Frequently Asked Questions

What is the IUPAC name of 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol?
The IUPAC name of 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol (CID 137045907) is 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol.
What is the SMILES notation for 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol?
The canonical SMILES for 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol is Nc1nnc(-c2ccccc2O)cc1N1CCCCC1.
What is the InChIKey of 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol?
The InChIKey is RJVQZTLPHCJXNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c16-15-13(19-8-4-1-5-9-19)10-12(17-18-15)11-6-2-3-7-14(11)20/h2-3,6-7,10,20H,1,4-5,8-9H2,(H2,16,18).
What are the key properties of 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol?
2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol has a molecular weight of 270.34 g/mol, XLogP of 2.42, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-amino-5-piperidin-1-ylpyridazin-3-yl)phenol is sourced from PubChem (CID 137045907), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).