6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine

C19H23N3O2 — CID 95463644

IUPAC6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine
SMILESCOc1ccccc1-c1ccc(N[C@H]2COC3(CCCC3)C2)nn1
InChIInChI=1S/C19H23N3O2/c1-23-17-7-3-2-6-15(17)16-8-9-18(22-21-16)20-14-12-19(24-13-14)10-4-5-11-19/h2-3,6-9,14H,4-5,10-13H2,1H3,(H,20,22)/t14-/m1/s1
InChIKeyZCWYEIAUYMEFCH-CQSZACIVSA-N
MW325.41 g/mol
LogP3.67
Rot. Bonds4

About 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine

6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine (PubChem CID 95463644) has the molecular formula C19H23N3O2 and a molecular weight of 325.41 g/mol. Its IUPAC name is 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine.

Molecular Properties

Compound Name6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine
PubChem CID95463644
Molecular FormulaC19H23N3O2
Molecular Weight325.41 g/mol
Exact Mass325.18
IUPAC Name6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine
SMILESCOc1ccccc1-c1ccc(N[C@H]2COC3(CCCC3)C2)nn1
InChIInChI=1S/C19H23N3O2/c1-23-17-7-3-2-6-15(17)16-8-9-18(22-21-16)20-14-12-19(24-13-14)10-4-5-11-19/h2-3,6-9,14H,4-5,10-13H2,1H3,(H,20,22)/t14-/m1/s1
InChIKeyZCWYEIAUYMEFCH-CQSZACIVSA-N
XLogP3.67
TPSA56.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500325.41
LogP ≤ 53.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine?
The IUPAC name of 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine (CID 95463644) is 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine.
What is the SMILES notation for 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine?
The canonical SMILES for 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine is COc1ccccc1-c1ccc(N[C@H]2COC3(CCCC3)C2)nn1.
What is the InChIKey of 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine?
The InChIKey is ZCWYEIAUYMEFCH-CQSZACIVSA-N. The full InChI is InChI=1S/C19H23N3O2/c1-23-17-7-3-2-6-15(17)16-8-9-18(22-21-16)20-14-12-19(24-13-14)10-4-5-11-19/h2-3,6-9,14H,4-5,10-13H2,1H3,(H,20,22)/t14-/m1/s1.
What are the key properties of 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine?
6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine has a molecular weight of 325.41 g/mol, XLogP of 3.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2-methoxyphenyl)-N-[(3R)-1-oxaspiro[4.4]nonan-3-yl]pyridazin-3-amine is sourced from PubChem (CID 95463644), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).