N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine

C17H19N5 — CID 134706886

IUPACN-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine
SMILESCCN(CCn1cccn1)c1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H19N5/c1-2-21(13-14-22-12-6-11-18-22)17-10-9-16(19-20-17)15-7-4-3-5-8-15/h3-12H,2,13-14H2,1H3
InChIKeySQYFXNVSGFLZNN-UHFFFAOYSA-N
MW293.37 g/mol
LogP2.87
Rot. Bonds6

About N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine

N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine (PubChem CID 134706886) has the molecular formula C17H19N5 and a molecular weight of 293.37 g/mol. Its IUPAC name is N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine.

Molecular Properties

Compound NameN-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine
PubChem CID134706886
Molecular FormulaC17H19N5
Molecular Weight293.37 g/mol
Exact Mass293.16
IUPAC NameN-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine
SMILESCCN(CCn1cccn1)c1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H19N5/c1-2-21(13-14-22-12-6-11-18-22)17-10-9-16(19-20-17)15-7-4-3-5-8-15/h3-12H,2,13-14H2,1H3
InChIKeySQYFXNVSGFLZNN-UHFFFAOYSA-N
XLogP2.87
TPSA46.84 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.37
LogP ≤ 52.87
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine?
The IUPAC name of N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine (CID 134706886) is N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine.
What is the SMILES notation for N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine?
The canonical SMILES for N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine is CCN(CCn1cccn1)c1ccc(-c2ccccc2)nn1.
What is the InChIKey of N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine?
The InChIKey is SQYFXNVSGFLZNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N5/c1-2-21(13-14-22-12-6-11-18-22)17-10-9-16(19-20-17)15-7-4-3-5-8-15/h3-12H,2,13-14H2,1H3.
What are the key properties of N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine?
N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine has a molecular weight of 293.37 g/mol, XLogP of 2.87, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-6-phenyl-N-(2-pyrazol-1-ylethyl)pyridazin-3-amine is sourced from PubChem (CID 134706886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).