[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine

C13H22N4O — CID 116972571

IUPAC[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine
SMILESCC(C)Cc1ccc(N2CCOC(CN)C2)nn1
InChIInChI=1S/C13H22N4O/c1-10(2)7-11-3-4-13(16-15-11)17-5-6-18-12(8-14)9-17/h3-4,10,12H,5-9,14H2,1-2H3
InChIKeyBCJXSMQQANSMIL-UHFFFAOYSA-N
MW250.35 g/mol
LogP0.84
Rot. Bonds4

About [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine

[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine (PubChem CID 116972571) has the molecular formula C13H22N4O and a molecular weight of 250.35 g/mol. Its IUPAC name is [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine.

Molecular Properties

Compound Name[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine
PubChem CID116972571
Molecular FormulaC13H22N4O
Molecular Weight250.35 g/mol
Exact Mass250.18
IUPAC Name[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine
SMILESCC(C)Cc1ccc(N2CCOC(CN)C2)nn1
InChIInChI=1S/C13H22N4O/c1-10(2)7-11-3-4-13(16-15-11)17-5-6-18-12(8-14)9-17/h3-4,10,12H,5-9,14H2,1-2H3
InChIKeyBCJXSMQQANSMIL-UHFFFAOYSA-N
XLogP0.84
TPSA64.27 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.35
LogP ≤ 50.84
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine 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 [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine?
The IUPAC name of [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine (CID 116972571) is [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine.
What is the SMILES notation for [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine?
The canonical SMILES for [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine is CC(C)Cc1ccc(N2CCOC(CN)C2)nn1.
What is the InChIKey of [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine?
The InChIKey is BCJXSMQQANSMIL-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H22N4O/c1-10(2)7-11-3-4-13(16-15-11)17-5-6-18-12(8-14)9-17/h3-4,10,12H,5-9,14H2,1-2H3.
What are the key properties of [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine?
[4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine has a molecular weight of 250.35 g/mol, XLogP of 0.84, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [4-[6-(2-methylpropyl)pyridazin-3-yl]morpholin-2-yl]methanamine is sourced from PubChem (CID 116972571), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).