3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide

C10H16N4O — CID 106895482

IUPAC3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide
SMILESCC(C)(CN)C(=O)NCc1cccnn1
InChIInChI=1S/C10H16N4O/c1-10(2,7-11)9(15)12-6-8-4-3-5-13-14-8/h3-5H,6-7,11H2,1-2H3,(H,12,15)
InChIKeyCPABJFWHUIZFBV-UHFFFAOYSA-N
MW208.26 g/mol
LogP0.08
Rot. Bonds4

About 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide

3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide (PubChem CID 106895482) has the molecular formula C10H16N4O and a molecular weight of 208.26 g/mol. Its IUPAC name is 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide.

Molecular Properties

Compound Name3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide
PubChem CID106895482
Molecular FormulaC10H16N4O
Molecular Weight208.26 g/mol
Exact Mass208.13
IUPAC Name3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide
SMILESCC(C)(CN)C(=O)NCc1cccnn1
InChIInChI=1S/C10H16N4O/c1-10(2,7-11)9(15)12-6-8-4-3-5-13-14-8/h3-5H,6-7,11H2,1-2H3,(H,12,15)
InChIKeyCPABJFWHUIZFBV-UHFFFAOYSA-N
XLogP0.08
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 ≤ 50.08
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-amino-2-methyl-N-(pyridazin-3-ylmethyl)butanamide
CID 106896008
3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)-3-sulfanylidenepropanamide
CID 106896266
2-amino-2-methyl-N-(pyridazin-3-ylmethyl)pentanamide
CID 106896146
2-amino-3,3-dimethyl-N-(pyridazin-3-ylmethyl)butanamide
CID 106896139
2-(tert-butylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106834522
4-(2-aminoethyl)-5,5-dimethyl-N-(pyridazin-3-ylmethyl)hexanamide
CID 106896004
4-(aminomethyl)-N-(pyridazin-3-ylmethyl)benzamide
CID 106894633
2-chloro-N-(pyridazin-3-ylmethyl)acetamide
CID 106895472
2-chloro-N-(pyridazin-3-ylmethyl)propanamide
CID 106895464
2-amino-3-methyl-N-(pyridazin-3-ylmethyl)benzamide
CID 106894585
2-hydroxyethyl N-(pyridazin-3-ylmethyl)carbamate
CID 106897873
2-(ethylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896183

Frequently Asked Questions

What is the IUPAC name of 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide?
The IUPAC name of 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide (CID 106895482) is 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide.
What is the SMILES notation for 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide?
The canonical SMILES for 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide is CC(C)(CN)C(=O)NCc1cccnn1.
What is the InChIKey of 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide?
The InChIKey is CPABJFWHUIZFBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4O/c1-10(2,7-11)9(15)12-6-8-4-3-5-13-14-8/h3-5H,6-7,11H2,1-2H3,(H,12,15).
What are the key properties of 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide?
3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide has a molecular weight of 208.26 g/mol, XLogP of 0.08, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-2,2-dimethyl-N-(pyridazin-3-ylmethyl)propanamide is sourced from PubChem (CID 106895482), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).