N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide

C16H19N5O — CID 113042823

IUPACN-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide
SMILESCN(CCc1ccncc1)c1ccc(NC(=O)C2CC2)nn1
InChIInChI=1S/C16H19N5O/c1-21(11-8-12-6-9-17-10-7-12)15-5-4-14(19-20-15)18-16(22)13-2-3-13/h4-7,9-10,13H,2-3,8,11H2,1H3,(H,18,19,22)
InChIKeySGVRQENWKGREBP-UHFFFAOYSA-N
MW297.36 g/mol
LogP1.90
Rot. Bonds6

About N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide

N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide (PubChem CID 113042823) has the molecular formula C16H19N5O and a molecular weight of 297.36 g/mol. Its IUPAC name is N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide.

Molecular Properties

Compound NameN-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide
PubChem CID113042823
Molecular FormulaC16H19N5O
Molecular Weight297.36 g/mol
Exact Mass297.16
IUPAC NameN-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide
SMILESCN(CCc1ccncc1)c1ccc(NC(=O)C2CC2)nn1
InChIInChI=1S/C16H19N5O/c1-21(11-8-12-6-9-17-10-7-12)15-5-4-14(19-20-15)18-16(22)13-2-3-13/h4-7,9-10,13H,2-3,8,11H2,1H3,(H,18,19,22)
InChIKeySGVRQENWKGREBP-UHFFFAOYSA-N
XLogP1.90
TPSA71.01 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

3,4-dimethyl-N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]benzamide
CID 113042844
N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]-3-phenoxypropanamide
CID 113042856
2-chloro-6-fluoro-N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]benzamide
CID 113042862
6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxylic acid
CID 54944199
N-[6-[butyl(methyl)amino]pyridazin-3-yl]oxane-4-carboxamide
CID 113044823
N-[2-(dimethylamino)ethyl]-6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxamide
CID 109115358
N-(5-methyl-1,2-oxazol-3-yl)-6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxamide
CID 109122658
N-(4-fluorophenyl)-6-[methyl(2-pyridin-4-ylethyl)amino]pyridazine-3-carboxamide
CID 109122614
6-(aminomethyl)-N-methyl-N-(2-pyridin-4-ylethyl)pyridazin-3-amine
CID 62285835
N-[6-(dipropylamino)pyridazin-3-yl]cyclohexanecarboxamide
CID 113045130
3,4-dimethyl-N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]benzenesulfonamide
CID 113042890
1-N-(3-cyanophenyl)-4-N-methyl-4-N-(2-pyridin-4-ylethyl)cyclohexane-1,4-dicarboxamide
CID 109149214

Frequently Asked Questions

What is the IUPAC name of N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide?
The IUPAC name of N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide (CID 113042823) is N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide.
What is the SMILES notation for N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide?
The canonical SMILES for N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide is CN(CCc1ccncc1)c1ccc(NC(=O)C2CC2)nn1.
What is the InChIKey of N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide?
The InChIKey is SGVRQENWKGREBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19N5O/c1-21(11-8-12-6-9-17-10-7-12)15-5-4-14(19-20-15)18-16(22)13-2-3-13/h4-7,9-10,13H,2-3,8,11H2,1H3,(H,18,19,22).
What are the key properties of N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide?
N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide has a molecular weight of 297.36 g/mol, XLogP of 1.90, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-[methyl(2-pyridin-4-ylethyl)amino]pyridazin-3-yl]cyclopropanecarboxamide is sourced from PubChem (CID 113042823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).