2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide

C11H17N3O — CID 90087202

IUPAC2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1cnnc(C(C)C)c1
InChIInChI=1S/C11H17N3O/c1-7(2)10-5-9(6-12-14-10)13-11(15)8(3)4/h5-8H,1-4H3,(H,13,14,15)
InChIKeyOGDFAEREFORWNB-UHFFFAOYSA-N
MW207.28 g/mol
LogP2.19
Rot. Bonds3

About 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide

2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide (PubChem CID 90087202) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide.

Molecular Properties

Compound Name2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide
PubChem CID90087202
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide
SMILESCC(C)C(=O)Nc1cnnc(C(C)C)c1
InChIInChI=1S/C11H17N3O/c1-7(2)10-5-9(6-12-14-10)13-11(15)8(3)4/h5-8H,1-4H3,(H,13,14,15)
InChIKeyOGDFAEREFORWNB-UHFFFAOYSA-N
XLogP2.19
TPSA54.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 52.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide?
The IUPAC name of 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide (CID 90087202) is 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide.
What is the SMILES notation for 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide?
The canonical SMILES for 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide is CC(C)C(=O)Nc1cnnc(C(C)C)c1.
What is the InChIKey of 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide?
The InChIKey is OGDFAEREFORWNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-7(2)10-5-9(6-12-14-10)13-11(15)8(3)4/h5-8H,1-4H3,(H,13,14,15).
What are the key properties of 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide?
2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide has a molecular weight of 207.28 g/mol, XLogP of 2.19, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(6-propan-2-ylpyridazin-4-yl)propanamide is sourced from PubChem (CID 90087202), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).