N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine

C7H9F2N3 — CID 106549890

IUPACN-(2,2-difluoroethyl)-5-methylpyridazin-3-amine
SMILESCc1cnnc(NCC(F)F)c1
InChIInChI=1S/C7H9F2N3/c1-5-2-7(12-11-3-5)10-4-6(8)9/h2-3,6H,4H2,1H3,(H,10,12)
InChIKeyMFFUPIBMFKZAKN-UHFFFAOYSA-N
MW173.17 g/mol
LogP1.46
Rot. Bonds3

About N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine

N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine (PubChem CID 106549890) has the molecular formula C7H9F2N3 and a molecular weight of 173.17 g/mol. Its IUPAC name is N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine.

Molecular Properties

Compound NameN-(2,2-difluoroethyl)-5-methylpyridazin-3-amine
PubChem CID106549890
Molecular FormulaC7H9F2N3
Molecular Weight173.17 g/mol
Exact Mass173.08
IUPAC NameN-(2,2-difluoroethyl)-5-methylpyridazin-3-amine
SMILESCc1cnnc(NCC(F)F)c1
InChIInChI=1S/C7H9F2N3/c1-5-2-7(12-11-3-5)10-4-6(8)9/h2-3,6H,4H2,1H3,(H,10,12)
InChIKeyMFFUPIBMFKZAKN-UHFFFAOYSA-N
XLogP1.46
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.17
LogP ≤ 51.46
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N,2-dimethyl-N'-(5-methylpyridazin-3-yl)propane-1,3-diamine
CID 106550243
3-amino-4-[(5-methylpyridazin-3-yl)amino]butan-2-ol
CID 106550190
2,2-difluoro-3-[(5-methylpyridazin-3-yl)amino]propan-1-ol
CID 106172005
N'-(5-methylpyridazin-3-yl)propane-1,3-diamine
CID 106549356
5-[(5-methylpyridazin-3-yl)amino]pentan-2-ol
CID 106128597
N-tert-butyl-2-[(5-methylpyridazin-3-yl)amino]acetamide
CID 106549887
2-N-(2,2-difluoroethyl)-5-methylpyridine-2,4-diamine
CID 83266255
N-but-3-ynyl-5-methylpyridazin-3-amine
CID 106549778
N,5-dimethylpyridazin-3-amine;ethane
CID 143330447
N'-(5-methylpyridazin-3-yl)pentane-1,5-diamine
CID 107323443
N'-(5-methylpyridazin-3-yl)hexane-1,6-diamine
CID 107845062
5-methyl-N-(3-methylbut-3-enyl)pyridazin-3-amine
CID 130908778

Frequently Asked Questions

What is the IUPAC name of N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine?
The IUPAC name of N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine (CID 106549890) is N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine.
What is the SMILES notation for N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine?
The canonical SMILES for N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine is Cc1cnnc(NCC(F)F)c1.
What is the InChIKey of N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine?
The InChIKey is MFFUPIBMFKZAKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9F2N3/c1-5-2-7(12-11-3-5)10-4-6(8)9/h2-3,6H,4H2,1H3,(H,10,12).
What are the key properties of N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine?
N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine has a molecular weight of 173.17 g/mol, XLogP of 1.46, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,2-difluoroethyl)-5-methylpyridazin-3-amine is sourced from PubChem (CID 106549890), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).