2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide

C10H16N4O — CID 106896008

IUPAC2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide
SMILESCCC(C)(N)C(=O)NCc1cccnn1
InChIInChI=1S/C10H16N4O/c1-3-10(2,11)9(15)12-7-8-5-4-6-13-14-8/h4-6H,3,7,11H2,1-2H3,(H,12,15)
InChIKeyVQDHCDJUBOUQMC-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.22
Rot. Bonds4

About 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide

2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide (PubChem CID 106896008) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide.

Molecular Properties

Compound Name2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide
PubChem CID106896008
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide
SMILESCCC(C)(N)C(=O)NCc1cccnn1
InChIInChI=1S/C10H16N4O/c1-3-10(2,11)9(15)12-7-8-5-4-6-13-14-8/h4-6H,3,7,11H2,1-2H3,(H,12,15)
InChIKeyVQDHCDJUBOUQMC-UHFFFAOYSA-N
XLogP0.22
TPSA80.90 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.26
LogP ≤ 50.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-methyl-N-(pyridazin-3-ylmethyl)pentanamide
CID 106896146
3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide
CID 106895482
3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)-3-sulfanylidenepropanamide
CID 106896266
2-amino-3,3-dimethyl-N-(pyridazin-3-ylmethyl)butanamide
CID 106896139
(2R)-2-amino-N-(pyridazin-3-ylmethyl)pentanamide
CID 107570944
2-(tert-butylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106834522
2-(ethylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896183
2-amino-2-methyl-N-(quinolin-8-ylmethyl)butanamide
CID 81426473
2-chloro-N-(pyridazin-3-ylmethyl)acetamide
CID 106895472
2-amino-N-[(2-chlorophenyl)methyl]-2-methylbutanamide
CID 79796852
2-chloro-N-(pyridazin-3-ylmethyl)propanamide
CID 106895464
2-(propylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896058

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide?
The IUPAC name of 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide (CID 106896008) is 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide.
What is the SMILES notation for 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide?
The canonical SMILES for 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide is CCC(C)(N)C(=O)NCc1cccnn1.
What is the InChIKey of 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide?
The InChIKey is VQDHCDJUBOUQMC-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-3-10(2,11)9(15)12-7-8-5-4-6-13-14-8/h4-6H,3,7,11H2,1-2H3,(H,12,15).
What are the key properties of 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide?
2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide has a molecular weight of 208.26 g/mol, XLogP of 0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide is sourced from PubChem (CID 106896008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).