2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide

C15H18N4O — CID 106896095

IUPAC2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide
SMILESCNCCc1ccccc1C(=O)NCc1cccnn1
InChIInChI=1S/C15H18N4O/c1-16-10-8-12-5-2-3-7-14(12)15(20)17-11-13-6-4-9-18-19-13/h2-7,9,16H,8,10-11H2,1H3,(H,17,20)
InChIKeyUDGBAJMKAFSFSJ-UHFFFAOYSA-N
MW270.34 g/mol
LogP1.17
Rot. Bonds6

About 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide

2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide (PubChem CID 106896095) has the molecular formula C15H18N4O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide.

Molecular Properties

Compound Name2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide
PubChem CID106896095
Molecular FormulaC15H18N4O
Molecular Weight270.34 g/mol
Exact Mass270.15
IUPAC Name2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide
SMILESCNCCc1ccccc1C(=O)NCc1cccnn1
InChIInChI=1S/C15H18N4O/c1-16-10-8-12-5-2-3-7-14(12)15(20)17-11-13-6-4-9-18-19-13/h2-7,9,16H,8,10-11H2,1H3,(H,17,20)
InChIKeyUDGBAJMKAFSFSJ-UHFFFAOYSA-N
XLogP1.17
TPSA66.91 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 51.17
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(4-hydroxyphenyl)methyl]-2-[2-(methylamino)ethyl]benzamide
CID 114332137
4-(methylamino)-N-(pyridazin-3-ylmethyl)pyridine-3-carboxamide
CID 106897669
2-amino-3-methyl-N-(pyridazin-3-ylmethyl)benzamide
CID 106894585
2-[2-(methylamino)ethyl]benzohydrazide
CID 104547939
3-[[2-[2-(methylamino)ethyl]benzoyl]amino]propanoic acid
CID 71070439
2-[2-(methylamino)ethyl]-N-[2-(methylamino)-2-oxoethyl]benzamide
CID 104547416
2-[2-(methylamino)ethyl]-N-[(5-methyl-1H-pyrazol-4-yl)methyl]benzamide
CID 104547624
2-[2-(methylamino)ethyl]-N-prop-2-enylbenzamide
CID 104547357
2-(2-aminophenyl)-N-(pyridazin-3-ylmethyl)acetamide
CID 106894537
2-[2-(methylamino)ethyl]benzamide
CID 69094527
N-(1-amino-2-methyl-1-oxopropan-2-yl)-2-[2-(methylamino)ethyl]benzamide
CID 104547692
N-(2-cyanoethyl)-2-[2-(methylamino)ethyl]benzamide
CID 113425664

Frequently Asked Questions

What is the IUPAC name of 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide?
The IUPAC name of 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide (CID 106896095) is 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide.
What is the SMILES notation for 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide?
The canonical SMILES for 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide is CNCCc1ccccc1C(=O)NCc1cccnn1.
What is the InChIKey of 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide?
The InChIKey is UDGBAJMKAFSFSJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N4O/c1-16-10-8-12-5-2-3-7-14(12)15(20)17-11-13-6-4-9-18-19-13/h2-7,9,16H,8,10-11H2,1H3,(H,17,20).
What are the key properties of 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide?
2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide has a molecular weight of 270.34 g/mol, XLogP of 1.17, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(methylamino)ethyl]-N-(pyridazin-3-ylmethyl)benzamide is sourced from PubChem (CID 106896095), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).