2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile

C11H10F3N3 — CID 114159032

IUPAC2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(NC2(C(F)(F)F)CC2)n1
InChIInChI=1S/C11H10F3N3/c1-7-4-8(6-15)5-9(16-7)17-10(2-3-10)11(12,13)14/h4-5H,2-3H2,1H3,(H,16,17)
InChIKeyMPYQGWYUNMYILF-UHFFFAOYSA-N
MW241.22 g/mol
LogP2.77
Rot. Bonds2

About 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile

2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile (PubChem CID 114159032) has the molecular formula C11H10F3N3 and a molecular weight of 241.22 g/mol. Its IUPAC name is 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile.

Molecular Properties

Compound Name2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile
PubChem CID114159032
Molecular FormulaC11H10F3N3
Molecular Weight241.22 g/mol
Exact Mass241.08
IUPAC Name2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile
SMILESCc1cc(C#N)cc(NC2(C(F)(F)F)CC2)n1
InChIInChI=1S/C11H10F3N3/c1-7-4-8(6-15)5-9(16-7)17-10(2-3-10)11(12,13)14/h4-5H,2-3H2,1H3,(H,16,17)
InChIKeyMPYQGWYUNMYILF-UHFFFAOYSA-N
XLogP2.77
TPSA48.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.22
LogP ≤ 52.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[(4-cyano-6-methyl-2-pyridinyl)amino]cyclopropane-1-carboxylic acid
CID 114765459
3,5-difluoro-4-[[1-(trifluoromethyl)cyclopropyl]amino]benzonitrile
CID 114159033
2-methyl-6-[(2-methylcyclopropyl)amino]pyridine-4-carbonitrile
CID 114766194
2-methyl-6-(2-methylbut-3-yn-2-ylamino)pyridine-4-carbonitrile
CID 114766321
2-(2,2-dimethylbutylamino)-6-methylpyridine-4-carbonitrile
CID 103461768
6-N-methyl-2-N-[1-(trifluoromethyl)cyclopropyl]pyrazine-2,6-diamine
CID 106219602
2-methyl-6-[[4-(methylamino)cyclohexyl]amino]pyridine-4-carbonitrile
CID 114770152
6-(trifluoromethyl)-4-N-[1-(trifluoromethyl)cyclopropyl]pyrimidine-2,4-diamine
CID 106219481
2-methyl-6-(2,3,5,6-tetrafluoroanilino)pyridine-4-carbonitrile
CID 107644839
5-methyl-2-N-[1-(trifluoromethyl)cyclopropyl]pyridine-2,4-diamine
CID 106217302
2-[(2-hydroxycycloheptyl)amino]-6-methylpyridine-4-carbonitrile
CID 114769770
2-(4-hydroxybutan-2-ylamino)-6-methylpyridine-4-carbonitrile
CID 114766557

Frequently Asked Questions

What is the IUPAC name of 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile?
The IUPAC name of 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile (CID 114159032) is 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile.
What is the SMILES notation for 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile?
The canonical SMILES for 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile is Cc1cc(C#N)cc(NC2(C(F)(F)F)CC2)n1.
What is the InChIKey of 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile?
The InChIKey is MPYQGWYUNMYILF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H10F3N3/c1-7-4-8(6-15)5-9(16-7)17-10(2-3-10)11(12,13)14/h4-5H,2-3H2,1H3,(H,16,17).
What are the key properties of 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile?
2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile has a molecular weight of 241.22 g/mol, XLogP of 2.77, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-6-[[1-(trifluoromethyl)cyclopropyl]amino]pyridine-4-carbonitrile is sourced from PubChem (CID 114159032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).