(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane

C10H15N4P — CID 156710909

IUPAC(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane
SMILESCC(C)C1=CN=NC2=CC(C)(P)C=NN21
InChIInChI=1S/C10H15N4P/c1-7(2)8-5-11-13-9-4-10(3,15)6-12-14(8)9/h4-7H,15H2,1-3H3
InChIKeyOSCAOTGNFGSHGM-UHFFFAOYSA-N
MW222.23 g/mol
LogP2.73
Rot. Bonds1

About (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane

(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane (PubChem CID 156710909) has the molecular formula C10H15N4P and a molecular weight of 222.23 g/mol. Its IUPAC name is (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane.

Molecular Properties

Compound Name(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane
PubChem CID156710909
Molecular FormulaC10H15N4P
Molecular Weight222.23 g/mol
Exact Mass222.10
IUPAC Name(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane
SMILESCC(C)C1=CN=NC2=CC(C)(P)C=NN21
InChIInChI=1S/C10H15N4P/c1-7(2)8-5-11-13-9-4-10(3,15)6-12-14(8)9/h4-7H,15H2,1-3H3
InChIKeyOSCAOTGNFGSHGM-UHFFFAOYSA-N
XLogP2.73
TPSA40.32 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.23
LogP ≤ 52.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'phosphor', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane?
The IUPAC name of (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane (CID 156710909) is (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane.
What is the SMILES notation for (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane?
The canonical SMILES for (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane is CC(C)C1=CN=NC2=CC(C)(P)C=NN21.
What is the InChIKey of (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane?
The InChIKey is OSCAOTGNFGSHGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N4P/c1-7(2)8-5-11-13-9-4-10(3,15)6-12-14(8)9/h4-7H,15H2,1-3H3.
What are the key properties of (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane?
(8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane has a molecular weight of 222.23 g/mol, XLogP of 2.73, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (8-methyl-4-propan-2-ylpyridazino[6,1-c][1,2,4]triazin-8-yl)phosphane is sourced from PubChem (CID 156710909), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).