N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine

C9H11N5 — CID 130658671

IUPACN-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine
SMILESc1cnnc(NCCc2cn[nH]c2)c1
InChIInChI=1S/C9H11N5/c1-2-9(14-11-4-1)10-5-3-8-6-12-13-7-8/h1-2,4,6-7H,3,5H2,(H,10,14)(H,12,13)
InChIKeyPCLIYIPQCOYAJD-UHFFFAOYSA-N
MW189.22 g/mol
LogP0.85
Rot. Bonds4

About N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine

N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine (PubChem CID 130658671) has the molecular formula C9H11N5 and a molecular weight of 189.22 g/mol. Its IUPAC name is N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine.

Molecular Properties

Compound NameN-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine
PubChem CID130658671
Molecular FormulaC9H11N5
Molecular Weight189.22 g/mol
Exact Mass189.10
IUPAC NameN-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine
SMILESc1cnnc(NCCc2cn[nH]c2)c1
InChIInChI=1S/C9H11N5/c1-2-9(14-11-4-1)10-5-3-8-6-12-13-7-8/h1-2,4,6-7H,3,5H2,(H,10,14)(H,12,13)
InChIKeyPCLIYIPQCOYAJD-UHFFFAOYSA-N
XLogP0.85
TPSA66.49 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.22
LogP ≤ 50.85
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(1H-imidazol-5-yl)ethyl]pyridazin-3-amine
CID 65231842
N-(2-thiophen-2-ylethyl)pyridazin-3-amine
CID 62481413
N-[2-(2-methylphenyl)ethyl]pyridazin-3-amine
CID 79034324
2-chloro-N-[2-(1H-pyrazol-4-yl)ethyl]-1,3-thiazol-4-amine
CID 130686344
1-methyl-2-[2-(1H-pyrazol-4-yl)ethyl]hydrazine
CID 144949085
N-[2-(1H-pyrazol-4-yl)ethyl]-1,4,5,6-tetrahydropyrimidin-2-amine
CID 127014926
methyl 3-(pyridazin-3-ylamino)propanoate
CID 62482435
1-(pyridazin-3-ylamino)pentan-3-ol
CID 115702161
N-[3-(2-chloroethoxy)propyl]pyridazin-3-amine
CID 106306361
2-[2-(pyridazin-3-ylamino)ethyl]guanidine
CID 130785372
4-methyl-6-[2-(1H-pyrazol-4-yl)ethylamino]pyridine-2-carbaldehyde
CID 170939362
N-(2-cyclobutylethyl)pyridazin-3-amine
CID 115689977

Frequently Asked Questions

What is the IUPAC name of N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine?
The IUPAC name of N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine (CID 130658671) is N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine.
What is the SMILES notation for N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine?
The canonical SMILES for N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine is c1cnnc(NCCc2cn[nH]c2)c1.
What is the InChIKey of N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine?
The InChIKey is PCLIYIPQCOYAJD-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11N5/c1-2-9(14-11-4-1)10-5-3-8-6-12-13-7-8/h1-2,4,6-7H,3,5H2,(H,10,14)(H,12,13).
What are the key properties of N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine?
N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine has a molecular weight of 189.22 g/mol, XLogP of 0.85, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(1H-pyrazol-4-yl)ethyl]pyridazin-3-amine is sourced from PubChem (CID 130658671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).