2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile

C8H7F2N3 — CID 130103307

IUPAC2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
SMILESCc1cc(C(F)F)nc(N)c1C#N
InChIInChI=1S/C8H7F2N3/c1-4-2-6(7(9)10)13-8(12)5(4)3-11/h2,7H,1H3,(H2,12,13)
InChIKeyAOIVCGJEZGGDGR-UHFFFAOYSA-N
MW183.16 g/mol
LogP1.78
Rot. Bonds1

About 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile

2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile (PubChem CID 130103307) has the molecular formula C8H7F2N3 and a molecular weight of 183.16 g/mol. Its IUPAC name is 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile.

Molecular Properties

Compound Name2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
PubChem CID130103307
Molecular FormulaC8H7F2N3
Molecular Weight183.16 g/mol
Exact Mass183.06
IUPAC Name2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile
SMILESCc1cc(C(F)F)nc(N)c1C#N
InChIInChI=1S/C8H7F2N3/c1-4-2-6(7(9)10)13-8(12)5(4)3-11/h2,7H,1H3,(H2,12,13)
InChIKeyAOIVCGJEZGGDGR-UHFFFAOYSA-N
XLogP1.78
TPSA62.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500183.16
LogP ≤ 51.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile?
The IUPAC name of 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile (CID 130103307) is 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile.
What is the SMILES notation for 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile?
The canonical SMILES for 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile is Cc1cc(C(F)F)nc(N)c1C#N.
What is the InChIKey of 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile?
The InChIKey is AOIVCGJEZGGDGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F2N3/c1-4-2-6(7(9)10)13-8(12)5(4)3-11/h2,7H,1H3,(H2,12,13).
What are the key properties of 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile?
2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile has a molecular weight of 183.16 g/mol, XLogP of 1.78, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-6-(difluoromethyl)-4-methylpyridine-3-carbonitrile is sourced from PubChem (CID 130103307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).