7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine

C8H5F3N4 — CID 150983052

IUPAC7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine
SMILESNc1ncc2ncc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H5F3N4/c9-8(10,11)4-1-5-6(13-2-4)3-14-7(12)15-5/h1-3H,(H2,12,14,15)
InChIKeyLQMQGKIDXZFGGH-UHFFFAOYSA-N
MW214.15 g/mol
LogP1.63
Rot. Bonds

About 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine

7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine (PubChem CID 150983052) has the molecular formula C8H5F3N4 and a molecular weight of 214.15 g/mol. Its IUPAC name is 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine.

Molecular Properties

Compound Name7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine
PubChem CID150983052
Molecular FormulaC8H5F3N4
Molecular Weight214.15 g/mol
Exact Mass214.05
IUPAC Name7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine
SMILESNc1ncc2ncc(C(F)(F)F)cc2n1
InChIInChI=1S/C8H5F3N4/c9-8(10,11)4-1-5-6(13-2-4)3-14-7(12)15-5/h1-3H,(H2,12,14,15)
InChIKeyLQMQGKIDXZFGGH-UHFFFAOYSA-N
XLogP1.63
TPSA64.69 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.15
LogP ≤ 51.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(trifluoromethyl)pyrimidin-2-amine
CID 15273574
7-bromopyrido[3,2-d]pyrimidin-2-amine
CID 122129854
6-(trifluoromethyl)quinazolin-2-amine
CID 10584686
7-(trifluoromethyl)quinoxalin-2-amine
CID 21313066
molecular hydrogen;5-(trifluoromethyl)pyrimidin-2-amine
CID 153387486
7-(trifluoromethyl)quinolin-3-amine
CID 22326826
5-[4-(trifluoromethyl)phenyl]pyrimidine-2,4-diamine
CID 10610924
6-bromo-3-(trifluoromethyl)quinoline
CID 150537973
2-methyl-6-(trifluoromethyl)-[1,3]thiazolo[5,4-b]pyridine
CID 122608305
7-tert-butyl-1,5-naphthyridin-2-amine
CID 164792594
2-(trifluoromethyl)benzo[f][1,7]naphthyridin-5-amine
CID 58213640
3-ethynyl-5-(trifluoromethyl)pyridin-2-amine
CID 30772124

Frequently Asked Questions

What is the IUPAC name of 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine?
The IUPAC name of 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine (CID 150983052) is 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine.
What is the SMILES notation for 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine?
The canonical SMILES for 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine is Nc1ncc2ncc(C(F)(F)F)cc2n1.
What is the InChIKey of 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine?
The InChIKey is LQMQGKIDXZFGGH-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H5F3N4/c9-8(10,11)4-1-5-6(13-2-4)3-14-7(12)15-5/h1-3H,(H2,12,14,15).
What are the key properties of 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine?
7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine has a molecular weight of 214.15 g/mol, XLogP of 1.63, 0 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-(trifluoromethyl)pyrido[3,2-d]pyrimidin-2-amine is sourced from PubChem (CID 150983052), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).