5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine

C7H7F3N2 — CID 130103932

IUPAC5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine
SMILESCc1c(C(F)F)cnc(F)c1N
InChIInChI=1S/C7H7F3N2/c1-3-4(6(8)9)2-12-7(10)5(3)11/h2,6H,11H2,1H3
InChIKeyRTKKQYJPCLFUHU-UHFFFAOYSA-N
MW176.14 g/mol
LogP2.05
Rot. Bonds1

About 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine

5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine (PubChem CID 130103932) has the molecular formula C7H7F3N2 and a molecular weight of 176.14 g/mol. Its IUPAC name is 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine.

Molecular Properties

Compound Name5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine
PubChem CID130103932
Molecular FormulaC7H7F3N2
Molecular Weight176.14 g/mol
Exact Mass176.06
IUPAC Name5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine
SMILESCc1c(C(F)F)cnc(F)c1N
InChIInChI=1S/C7H7F3N2/c1-3-4(6(8)9)2-12-7(10)5(3)11/h2,6H,11H2,1H3
InChIKeyRTKKQYJPCLFUHU-UHFFFAOYSA-N
XLogP2.05
TPSA38.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.14
LogP ≤ 52.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

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Related Compounds

5-(difluoromethyl)-2-fluoro-4-iodo-3-methylpyridine
CID 130079918
5-(difluoromethyl)-2-fluoro-4-methylpyridine-3-carbaldehyde
CID 130081163
5-(difluoromethyl)-3-fluoro-2,4-dimethylpyridine
CID 130101103
5-(difluoromethyl)-2-fluoro-3-methyl-4-(trifluoromethyl)pyridine
CID 133104534
ethyl 3-amino-5-(difluoromethyl)-4-methylpyridine-2-carboxylate
CID 134673817
4-bromo-5-(difluoromethyl)-3-methylpyridin-2-amine
CID 119025264
4-(difluoromethyl)-2-fluoro-3-iodo-5-methylpyridine
CID 118840077
5-(difluoromethyl)-3-fluoro-4-methylpyridine-2-carbaldehyde
CID 130081157
2-bromo-5-(difluoromethyl)-4-fluoro-3-methylpyridine
CID 130109380
3,4-dichloro-5-(difluoromethyl)-2-fluoropyridine
CID 130099211
5-(difluoromethyl)-2-fluoro-3,4-diiodopyridine
CID 130100485
3-(difluoromethyl)-2,5-difluoropyridine
CID 70480194

Frequently Asked Questions

What is the IUPAC name of 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine?
The IUPAC name of 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine (CID 130103932) is 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine.
What is the SMILES notation for 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine?
The canonical SMILES for 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine is Cc1c(C(F)F)cnc(F)c1N.
What is the InChIKey of 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine?
The InChIKey is RTKKQYJPCLFUHU-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H7F3N2/c1-3-4(6(8)9)2-12-7(10)5(3)11/h2,6H,11H2,1H3.
What are the key properties of 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine?
5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine has a molecular weight of 176.14 g/mol, XLogP of 2.05, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(difluoromethyl)-2-fluoro-4-methylpyridin-3-amine is sourced from PubChem (CID 130103932), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).