2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol

C11H17N3O — CID 106895006

IUPAC2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol
SMILESCC1(C)C(O)CC1NCc1cccnn1
InChIInChI=1S/C11H17N3O/c1-11(2)9(6-10(11)15)12-7-8-4-3-5-13-14-8/h3-5,9-10,12,15H,6-7H2,1-2H3
InChIKeyFZYNRQIIPWJQDN-UHFFFAOYSA-N
MW207.28 g/mol
LogP0.73
Rot. Bonds3

About 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol

2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol (PubChem CID 106895006) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol.

Molecular Properties

Compound Name2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol
PubChem CID106895006
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol
SMILESCC1(C)C(O)CC1NCc1cccnn1
InChIInChI=1S/C11H17N3O/c1-11(2)9(6-10(11)15)12-7-8-4-3-5-13-14-8/h3-5,9-10,12,15H,6-7H2,1-2H3
InChIKeyFZYNRQIIPWJQDN-UHFFFAOYSA-N
XLogP0.73
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 50.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-[[1-(Methoxymethyl)cyclobutyl]methyl]-3-(pyridazin-3-ylmethyl)urea
CID 121526003
2-(Pyridazin-3-ylmethylamino)ethanol
CID 19091430
3-methoxy-N-(pyridazin-3-ylmethyl)propan-1-amine
CID 70656050
N-propan-2-ylpropan-2-amine;1-pyridazin-3-ylpropan-2-ol
CID 158426515
2-(Tert-butylamino)-2-(5-methylpyridazin-3-yl)ethanol
CID 175223091
2-(1-Pyridazin-3-ylethylamino)ethanol
CID 176134115
2-Pyridazin-3-ylpyrrolidin-3-ol
CID 82414605
4-methoxy-N-(pyridazin-3-ylmethyl)butan-2-amine
CID 106832004
2-propyl-N-(pyridazin-3-ylmethyl)oxan-4-amine
CID 106833900
4-methoxy-4-methyl-N-(pyridazin-3-ylmethyl)pentan-2-amine
CID 106833950
N-(pyridazin-3-ylmethyl)oxan-4-amine
CID 106833998
2-propan-2-yl-N-(pyridazin-3-ylmethyl)oxan-4-amine
CID 106834018

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol?
The IUPAC name of 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol (CID 106895006) is 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol.
What is the SMILES notation for 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol?
The canonical SMILES for 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol is CC1(C)C(O)CC1NCc1cccnn1.
What is the InChIKey of 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol?
The InChIKey is FZYNRQIIPWJQDN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-11(2)9(6-10(11)15)12-7-8-4-3-5-13-14-8/h3-5,9-10,12,15H,6-7H2,1-2H3.
What are the key properties of 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol?
2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol has a molecular weight of 207.28 g/mol, XLogP of 0.73, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-3-(pyridazin-3-ylmethylamino)cyclobutan-1-ol is sourced from PubChem (CID 106895006), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).