2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine

C7H8F3N3 — CID 172685718

IUPAC2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine
SMILESCNc1nccc(C(F)(F)F)c1N
InChIInChI=1S/C7H8F3N3/c1-12-6-5(11)4(2-3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13)
InChIKeyAZWAWGVMHRMQCM-UHFFFAOYSA-N
MW191.16 g/mol
LogP1.72
Rot. Bonds1

About 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine

2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine (PubChem CID 172685718) has the molecular formula C7H8F3N3 and a molecular weight of 191.16 g/mol. Its IUPAC name is 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine.

Molecular Properties

Compound Name2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine
PubChem CID172685718
Molecular FormulaC7H8F3N3
Molecular Weight191.16 g/mol
Exact Mass191.07
IUPAC Name2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine
SMILESCNc1nccc(C(F)(F)F)c1N
InChIInChI=1S/C7H8F3N3/c1-12-6-5(11)4(2-3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13)
InChIKeyAZWAWGVMHRMQCM-UHFFFAOYSA-N
XLogP1.72
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.16
LogP ≤ 51.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-N-methylpyridine-2,3,4-triamine
CID 130593934
3-N,2-dimethyl-5-(trifluoromethyl)pyridine-3,4-diamine
CID 172738194
3-amino-4-(trifluoromethyl)pyridine-2-carbaldehyde
CID 131117139
3-(1,1-difluoroethyl)-N-methylpyridin-2-amine
CID 89432261
4-tert-butyl-3-chloro-N-methylpyridin-2-amine
CID 162501216
2-[3-amino-4-(trifluoromethyl)-2-pyridinyl]acetic acid
CID 133098315
[3-hydroxy-4-(trifluoromethyl)-2-pyridinyl]urea
CID 69286520
ethyl 2-[3-amino-4-(trifluoromethyl)-2-pyridinyl]acetate
CID 133098254
N-methyl-4-(trifluoromethyl)pyridin-3-amine
CID 67229905
[2-amino-4-(trifluoromethyl)-3-pyridinyl]methanol
CID 118704003
4-(1,1-difluoroethyl)-N-methylpyrimidin-2-amine
CID 178103545
7-methyl-4-(trifluoromethyl)quinolin-6-amine
CID 143662930

Frequently Asked Questions

What is the IUPAC name of 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine?
The IUPAC name of 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine (CID 172685718) is 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine.
What is the SMILES notation for 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine?
The canonical SMILES for 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine is CNc1nccc(C(F)(F)F)c1N.
What is the InChIKey of 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine?
The InChIKey is AZWAWGVMHRMQCM-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8F3N3/c1-12-6-5(11)4(2-3-13-6)7(8,9)10/h2-3H,11H2,1H3,(H,12,13).
What are the key properties of 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine?
2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine has a molecular weight of 191.16 g/mol, XLogP of 1.72, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-methyl-4-(trifluoromethyl)pyridine-2,3-diamine is sourced from PubChem (CID 172685718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).