N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine

C14H18N4 — CID 82191427

IUPACN'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine
SMILESCc1ccc(-c2ccc(NCCN)nn2)c(C)c1
InChIInChI=1S/C14H18N4/c1-10-3-4-12(11(2)9-10)13-5-6-14(18-17-13)16-8-7-15/h3-6,9H,7-8,15H2,1-2H3,(H,16,18)
InChIKeyLXWMMIFSRFFZDZ-UHFFFAOYSA-N
MW242.33 g/mol
LogP2.13
Rot. Bonds4

About N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine

N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine (PubChem CID 82191427) has the molecular formula C14H18N4 and a molecular weight of 242.33 g/mol. Its IUPAC name is N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine
PubChem CID82191427
Molecular FormulaC14H18N4
Molecular Weight242.33 g/mol
Exact Mass242.15
IUPAC NameN'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine
SMILESCc1ccc(-c2ccc(NCCN)nn2)c(C)c1
InChIInChI=1S/C14H18N4/c1-10-3-4-12(11(2)9-10)13-5-6-14(18-17-13)16-8-7-15/h3-6,9H,7-8,15H2,1-2H3,(H,16,18)
InChIKeyLXWMMIFSRFFZDZ-UHFFFAOYSA-N
XLogP2.13
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.33
LogP ≤ 52.13
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[[6-(2,4-dimethylphenyl)pyridazin-3-yl]amino]ethanethiol
CID 116971594
6-(2,4-dimethylphenyl)-N-ethylpyridazin-3-amine
CID 62204080
2-N-[6-(2,4-dimethylphenyl)pyridazin-3-yl]propane-1,2-diamine
CID 116970517
3-[[6-(2,5-dimethylphenyl)pyridazin-3-yl]amino]propanenitrile
CID 116971919
N'-[6-(4-methylphenyl)pyrimidin-4-yl]ethane-1,2-diamine
CID 82473894
N'-[6-(5-methylfuran-2-yl)pyridazin-3-yl]ethane-1,2-diamine
CID 116970435
N'-[6-(3,4-difluorophenyl)pyridazin-3-yl]ethane-1,2-diamine
CID 116970403
1-N-[6-(2-methylphenyl)pyridazin-3-yl]butane-1,3-diamine
CID 116970835
N'-(6-tert-butylpyridazin-3-yl)ethane-1,2-diamine
CID 84665671
N'-[6-(4-bromophenyl)pyridazin-3-yl]ethane-1,2-diamine
CID 82191433
N'-[6-(4-chlorophenyl)pyridazin-3-yl]ethane-1,2-diamine
CID 82191432
N-methyl-N'-[6-(3-methylphenyl)pyridazin-3-yl]propane-1,3-diamine
CID 116970734

Frequently Asked Questions

What is the IUPAC name of N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine?
The IUPAC name of N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine (CID 82191427) is N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine.
What is the SMILES notation for N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine?
The canonical SMILES for N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine is Cc1ccc(-c2ccc(NCCN)nn2)c(C)c1.
What is the InChIKey of N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine?
The InChIKey is LXWMMIFSRFFZDZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N4/c1-10-3-4-12(11(2)9-10)13-5-6-14(18-17-13)16-8-7-15/h3-6,9H,7-8,15H2,1-2H3,(H,16,18).
What are the key properties of N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine?
N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine has a molecular weight of 242.33 g/mol, XLogP of 2.13, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-[6-(2,4-dimethylphenyl)pyridazin-3-yl]ethane-1,2-diamine is sourced from PubChem (CID 82191427), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).