5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine

C12H21N3 — CID 106549770

IUPAC5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine
SMILESCc1cnnc(NC(C)CCC(C)C)c1
InChIInChI=1S/C12H21N3/c1-9(2)5-6-11(4)14-12-7-10(3)8-13-15-12/h7-9,11H,5-6H2,1-4H3,(H,14,15)
InChIKeyRCBDGRIPCXXYFF-UHFFFAOYSA-N
MW207.32 g/mol
LogP3.02
Rot. Bonds5

About 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine

5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine (PubChem CID 106549770) has the molecular formula C12H21N3 and a molecular weight of 207.32 g/mol. Its IUPAC name is 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine.

Molecular Properties

Compound Name5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine
PubChem CID106549770
Molecular FormulaC12H21N3
Molecular Weight207.32 g/mol
Exact Mass207.17
IUPAC Name5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine
SMILESCc1cnnc(NC(C)CCC(C)C)c1
InChIInChI=1S/C12H21N3/c1-9(2)5-6-11(4)14-12-7-10(3)8-13-15-12/h7-9,11H,5-6H2,1-4H3,(H,14,15)
InChIKeyRCBDGRIPCXXYFF-UHFFFAOYSA-N
XLogP3.02
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.32
LogP ≤ 53.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-heptan-2-yl-5-methylpyridazin-3-amine
CID 106549626
N-(1-ethoxypropan-2-yl)-5-methylpyridazin-3-amine
CID 106549675
4-methyl-2-N-(5-methylpyridazin-3-yl)pentane-1,2-diamine
CID 106550178
3-[(5-methylpyridazin-3-yl)amino]pentan-1-ol
CID 106549992
N,2-dimethyl-N'-(5-methylpyridazin-3-yl)propane-1,3-diamine
CID 106550243
5-methyl-2-N-(5-methylhexan-2-yl)pyridine-2,3-diamine
CID 66278018
5-methyl-N-(1-methylsulfanylbutan-2-yl)pyridazin-3-amine
CID 106549990
N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine
CID 106549890
5-[(5-methylpyridazin-3-yl)amino]pentan-2-ol
CID 106128597
2-methyl-4-N-(5-methylhexan-2-yl)pyrimidine-4,6-diamine
CID 80838338
N,5-dimethylpyridazin-3-amine;ethane
CID 143330447
3-methoxy-2-N-(5-methylpyridazin-3-yl)propane-1,2-diamine
CID 106182176

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine?
The IUPAC name of 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine (CID 106549770) is 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine.
What is the SMILES notation for 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine?
The canonical SMILES for 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine is Cc1cnnc(NC(C)CCC(C)C)c1.
What is the InChIKey of 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine?
The InChIKey is RCBDGRIPCXXYFF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N3/c1-9(2)5-6-11(4)14-12-7-10(3)8-13-15-12/h7-9,11H,5-6H2,1-4H3,(H,14,15).
What are the key properties of 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine?
5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine has a molecular weight of 207.32 g/mol, XLogP of 3.02, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(5-methylhexan-2-yl)pyridazin-3-amine is sourced from PubChem (CID 106549770), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).