N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide

C11H18N4O — CID 106895876

IUPACN-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide
SMILESCC(C)N(C)C(=O)CNCc1cccnn1
InChIInChI=1S/C11H18N4O/c1-9(2)15(3)11(16)8-12-7-10-5-4-6-13-14-10/h4-6,9,12H,7-8H2,1-3H3
InChIKeyWDQBKYWAOQCJBN-UHFFFAOYSA-N
MW222.29 g/mol
LogP0.43
Rot. Bonds5

About N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide

N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide (PubChem CID 106895876) has the molecular formula C11H18N4O and a molecular weight of 222.29 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide
PubChem CID106895876
Molecular FormulaC11H18N4O
Molecular Weight222.29 g/mol
Exact Mass222.15
IUPAC NameN-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide
SMILESCC(C)N(C)C(=O)CNCc1cccnn1
InChIInChI=1S/C11H18N4O/c1-9(2)15(3)11(16)8-12-7-10-5-4-6-13-14-10/h4-6,9,12H,7-8H2,1-3H3
InChIKeyWDQBKYWAOQCJBN-UHFFFAOYSA-N
XLogP0.43
TPSA58.12 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 50.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-2-(1,2-oxazol-3-ylmethylamino)-N-propan-2-ylacetamide
CID 81176958
2-methyl-3-(pyridazin-3-ylmethylamino)propanamide
CID 106895597
2-methyl-3-(pyridazin-3-ylmethylamino)propanoic acid
CID 106895586
N-methyl-N-propan-2-yl-2-(2-pyridin-2-ylethylamino)acetamide
CID 28579267
N-phenyl-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895878
2-chloro-N-(pyridazin-3-ylmethyl)propanamide
CID 106895464
2-[(4-fluorophenyl)methylamino]-N-methyl-N-propan-2-ylacetamide
CID 28581707
2-(ethylamino)-N-(pyridazin-3-ylmethyl)acetamide
CID 106896183
2-methoxy-N-(pyridazin-3-ylmethyl)propan-1-amine
CID 106895779
2-ethylsulfonyl-N-(pyridazin-3-ylmethyl)ethanamine
CID 106895585
N-(4-fluorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895590
N-(2-chlorophenyl)-2-(pyridazin-3-ylmethylamino)acetamide
CID 106895695

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide?
The IUPAC name of N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide (CID 106895876) is N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide.
What is the SMILES notation for N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide?
The canonical SMILES for N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide is CC(C)N(C)C(=O)CNCc1cccnn1.
What is the InChIKey of N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide?
The InChIKey is WDQBKYWAOQCJBN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N4O/c1-9(2)15(3)11(16)8-12-7-10-5-4-6-13-14-10/h4-6,9,12H,7-8H2,1-3H3.
What are the key properties of N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide?
N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide has a molecular weight of 222.29 g/mol, XLogP of 0.43, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-2-(pyridazin-3-ylmethylamino)acetamide is sourced from PubChem (CID 106895876), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).