6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine

C8H12N4O — CID 134405967

IUPAC6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine
SMILESCNc1ccc(OC2CNC2)nn1
InChIInChI=1S/C8H12N4O/c1-9-7-2-3-8(12-11-7)13-6-4-10-5-6/h2-3,6,10H,4-5H2,1H3,(H,9,11)
InChIKeyQOBHJQXNOREQLV-UHFFFAOYSA-N
MW180.21 g/mol
LogP-0.13
Rot. Bonds3

About 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine

6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine (PubChem CID 134405967) has the molecular formula C8H12N4O and a molecular weight of 180.21 g/mol. Its IUPAC name is 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine.

Molecular Properties

Compound Name6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine
PubChem CID134405967
Molecular FormulaC8H12N4O
Molecular Weight180.21 g/mol
Exact Mass180.10
IUPAC Name6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine
SMILESCNc1ccc(OC2CNC2)nn1
InChIInChI=1S/C8H12N4O/c1-9-7-2-3-8(12-11-7)13-6-4-10-5-6/h2-3,6,10H,4-5H2,1H3,(H,9,11)
InChIKeyQOBHJQXNOREQLV-UHFFFAOYSA-N
XLogP-0.13
TPSA59.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.21
LogP ≤ 5-0.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

CID 33677212
CID 33677212
CID 100696617
CID 100696617
CID 124116811
CID 124116811
CID 134405972
CID 134405972
CID 163467291
CID 163467291
CID 167506614
CID 167506614
CID 167506839
CID 167506839
CID 175417289
CID 175417289
CID 53913987
CID 53913987
CID 582061
CID 582061
CID 119094680
CID 119094680
CID 12320365
CID 12320365

Frequently Asked Questions

What is the IUPAC name of 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine?
The IUPAC name of 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine (CID 134405967) is 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine.
What is the SMILES notation for 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine?
The canonical SMILES for 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine is CNc1ccc(OC2CNC2)nn1.
What is the InChIKey of 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine?
The InChIKey is QOBHJQXNOREQLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H12N4O/c1-9-7-2-3-8(12-11-7)13-6-4-10-5-6/h2-3,6,10H,4-5H2,1H3,(H,9,11).
What are the key properties of 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine?
6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine has a molecular weight of 180.21 g/mol, XLogP of -0.13, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(azetidin-3-yloxy)-N-methylpyridazin-3-amine is sourced from PubChem (CID 134405967), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).