6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine

C14H16ClN3 — CID 71528504

IUPAC6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine
SMILESCCN(CC)c1ccc(-c2cccc(Cl)c2)nn1
InChIInChI=1S/C14H16ClN3/c1-3-18(4-2)14-9-8-13(16-17-14)11-6-5-7-12(15)10-11/h5-10H,3-4H2,1-2H3
InChIKeyCGZDBRRUIJPERD-UHFFFAOYSA-N
MW261.76 g/mol
LogP3.64
Rot. Bonds4

About 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine

6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine (PubChem CID 71528504) has the molecular formula C14H16ClN3 and a molecular weight of 261.76 g/mol. Its IUPAC name is 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine.

Molecular Properties

Compound Name6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine
PubChem CID71528504
Molecular FormulaC14H16ClN3
Molecular Weight261.76 g/mol
Exact Mass261.10
IUPAC Name6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine
SMILESCCN(CC)c1ccc(-c2cccc(Cl)c2)nn1
InChIInChI=1S/C14H16ClN3/c1-3-18(4-2)14-9-8-13(16-17-14)11-6-5-7-12(15)10-11/h5-10H,3-4H2,1-2H3
InChIKeyCGZDBRRUIJPERD-UHFFFAOYSA-N
XLogP3.64
TPSA29.02 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.76
LogP ≤ 53.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine?
The IUPAC name of 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine (CID 71528504) is 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine.
What is the SMILES notation for 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine?
The canonical SMILES for 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine is CCN(CC)c1ccc(-c2cccc(Cl)c2)nn1.
What is the InChIKey of 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine?
The InChIKey is CGZDBRRUIJPERD-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16ClN3/c1-3-18(4-2)14-9-8-13(16-17-14)11-6-5-7-12(15)10-11/h5-10H,3-4H2,1-2H3.
What are the key properties of 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine?
6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine has a molecular weight of 261.76 g/mol, XLogP of 3.64, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-chlorophenyl)-N,N-diethylpyridazin-3-amine is sourced from PubChem (CID 71528504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).