2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine

C14H21N5 — CID 105161684

IUPAC2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine
SMILESCCc1cc(CC(NC)c2ccnnc2)n(CC)n1
InChIInChI=1S/C14H21N5/c1-4-12-8-13(19(5-2)18-12)9-14(15-3)11-6-7-16-17-10-11/h6-8,10,14-15H,4-5,9H2,1-3H3
InChIKeyCIBSCFYJTOYYMW-UHFFFAOYSA-N
MW259.36 g/mol
LogP1.76
Rot. Bonds6

About 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine

2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine (PubChem CID 105161684) has the molecular formula C14H21N5 and a molecular weight of 259.36 g/mol. Its IUPAC name is 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine.

Molecular Properties

Compound Name2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine
PubChem CID105161684
Molecular FormulaC14H21N5
Molecular Weight259.36 g/mol
Exact Mass259.18
IUPAC Name2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine
SMILESCCc1cc(CC(NC)c2ccnnc2)n(CC)n1
InChIInChI=1S/C14H21N5/c1-4-12-8-13(19(5-2)18-12)9-14(15-3)11-6-7-16-17-10-11/h6-8,10,14-15H,4-5,9H2,1-3H3
InChIKeyCIBSCFYJTOYYMW-UHFFFAOYSA-N
XLogP1.76
TPSA55.63 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.36
LogP ≤ 51.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-(5-methyl-3-pyridinyl)ethanamine
CID 105161681
1-(2,6-dichlorophenyl)-2-(1,3-diethylpyrazol-5-yl)-N-methylethanamine
CID 105001665
N-[2-(3-ethyl-1-methylpyrazol-5-yl)-1-pyridazin-4-ylethyl]propan-1-amine
CID 105160172
2-(1,3-diethylpyrazol-5-yl)-1-(2,4-dimethylphenyl)-N-methylethanamine
CID 105001550
[2-(1,3-diethylpyrazol-5-yl)-1-(4-methyl-3-pyridinyl)ethyl]hydrazine
CID 105279906
1-(2-bromo-4-methylphenyl)-2-(1,3-diethylpyrazol-5-yl)-N-methylethanamine
CID 105001613
1-(2-chloro-6-fluorophenyl)-2-(1,3-diethylpyrazol-5-yl)-N-methylethanamine
CID 105001764
[2-(1,3-diethylpyrazol-5-yl)-1-(3-ethyl-4-pyridinyl)ethyl]hydrazine
CID 105262256
2-(4-chloro-3-ethyl-1-methylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine
CID 105159900
[2-(1,3-diethylpyrazol-5-yl)-1-(3-fluoro-4-pyridinyl)ethyl]hydrazine
CID 105258682
1-(1,3-diethylpyrazol-5-yl)-N-methylhexan-2-amine
CID 79404804
1-(2,6-dimethyl-4-pyridinyl)-2-(2-ethyl-5-methylpyrazol-3-yl)-N-methylethanamine
CID 107503544

Frequently Asked Questions

What is the IUPAC name of 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine?
The IUPAC name of 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine (CID 105161684) is 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine.
What is the SMILES notation for 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine?
The canonical SMILES for 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine is CCc1cc(CC(NC)c2ccnnc2)n(CC)n1.
What is the InChIKey of 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine?
The InChIKey is CIBSCFYJTOYYMW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N5/c1-4-12-8-13(19(5-2)18-12)9-14(15-3)11-6-7-16-17-10-11/h6-8,10,14-15H,4-5,9H2,1-3H3.
What are the key properties of 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine?
2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine has a molecular weight of 259.36 g/mol, XLogP of 1.76, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,3-diethylpyrazol-5-yl)-N-methyl-1-pyridazin-4-ylethanamine is sourced from PubChem (CID 105161684), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).