2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

C15H12F3N3 — CID 62197448

IUPAC2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
SMILESCCNc1nc(-c2ccccc2C(F)(F)F)ccc1C#N
InChIInChI=1S/C15H12F3N3/c1-2-20-14-10(9-19)7-8-13(21-14)11-5-3-4-6-12(11)15(16,17)18/h3-8H,2H2,1H3,(H,20,21)
InChIKeyWPGWAYSCJDSYLV-UHFFFAOYSA-N
MW291.28 g/mol
LogP4.07
Rot. Bonds3

About 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile

2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile (PubChem CID 62197448) has the molecular formula C15H12F3N3 and a molecular weight of 291.28 g/mol. Its IUPAC name is 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.

Molecular Properties

Compound Name2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
PubChem CID62197448
Molecular FormulaC15H12F3N3
Molecular Weight291.28 g/mol
Exact Mass291.10
IUPAC Name2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile
SMILESCCNc1nc(-c2ccccc2C(F)(F)F)ccc1C#N
InChIInChI=1S/C15H12F3N3/c1-2-20-14-10(9-19)7-8-13(21-14)11-5-3-4-6-12(11)15(16,17)18/h3-8H,2H2,1H3,(H,20,21)
InChIKeyWPGWAYSCJDSYLV-UHFFFAOYSA-N
XLogP4.07
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500291.28
LogP ≤ 54.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

6-(4-bromophenyl)-2-(ethylamino)pyridine-3-carbonitrile
CID 62198237
6-(4-chlorophenyl)-2-(ethylamino)pyridine-3-carbonitrile
CID 62197446
2-(ethylamino)-6-(4-ethylphenyl)pyridine-3-carbonitrile
CID 55045466
2-(ethylamino)-6-(3-methylphenyl)pyridine-3-carbonitrile
CID 62196307
6-(1-benzothiophen-2-yl)-2-(ethylamino)pyridine-3-carbonitrile
CID 114911037
2-(ethylamino)-6-(5-ethylthiophen-2-yl)pyridine-3-carbonitrile
CID 55045564
2-(ethylamino)-6-(1,3,5-trimethylpyrazol-4-yl)pyridine-3-carbonitrile
CID 62196811
6-(2-ethoxyphenyl)-2-hydrazinylpyridine-3-carbonitrile
CID 62252468
2-(2-methylpropylamino)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 78966408
2-(2-aminobutylamino)-6-(trifluoromethyl)pyridine-3-carbonitrile
CID 79877084
2,4-bis[2-(trifluoromethyl)phenyl]pyrimidine
CID 174722117
N-ethyl-3-(trifluoromethyl)pyridin-2-amine
CID 23541253

Frequently Asked Questions

What is the IUPAC name of 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The IUPAC name of 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile (CID 62197448) is 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile.
What is the SMILES notation for 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The canonical SMILES for 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile is CCNc1nc(-c2ccccc2C(F)(F)F)ccc1C#N.
What is the InChIKey of 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
The InChIKey is WPGWAYSCJDSYLV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12F3N3/c1-2-20-14-10(9-19)7-8-13(21-14)11-5-3-4-6-12(11)15(16,17)18/h3-8H,2H2,1H3,(H,20,21).
What are the key properties of 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile?
2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile has a molecular weight of 291.28 g/mol, XLogP of 4.07, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(ethylamino)-6-[2-(trifluoromethyl)phenyl]pyridine-3-carbonitrile is sourced from PubChem (CID 62197448), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).