2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine

C9H9F3N2 — CID 91528254

IUPAC2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
SMILESFC(F)(F)C1CCN2C=CC=CC2=N1
InChIInChI=1S/C9H9F3N2/c10-9(11,12)7-4-6-14-5-2-1-3-8(14)13-7/h1-3,5,7H,4,6H2
InChIKeyRUZFJIWPXVOPED-UHFFFAOYSA-N
MW202.18 g/mol
LogP2.11
Rot. Bonds

About 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine

2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine (PubChem CID 91528254) has the molecular formula C9H9F3N2 and a molecular weight of 202.18 g/mol. Its IUPAC name is 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine.

Molecular Properties

Compound Name2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
PubChem CID91528254
Molecular FormulaC9H9F3N2
Molecular Weight202.18 g/mol
Exact Mass202.07
IUPAC Name2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
SMILESFC(F)(F)C1CCN2C=CC=CC2=N1
InChIInChI=1S/C9H9F3N2/c10-9(11,12)7-4-6-14-5-2-1-3-8(14)13-7/h1-3,5,7H,4,6H2
InChIKeyRUZFJIWPXVOPED-UHFFFAOYSA-N
XLogP2.11
TPSA15.60 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.18
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

3,4-Dihydro-2h-pyrido[1,2-a]pyrimidine
CID 21111582
4,9-dimethyl-2,2-bis(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine
CID 5147575
4-methyl-2,2-bis(trifluoromethyl)-2H-pyrido[1,2-a][1,3,5]triazine
CID 5226153
2-(fluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 141053132
7-fluoro-4H-pyrido[1,2-a]pyrimidine
CID 169220442
4-Fluoro-2,4-bis(1,1,2,2,3,3,3-heptafluoropropyl)pyrido[1,2-a][1,3,5]triazine
CID 15517144
2-Fluoro-2,4-bis(1,1,2,2,3,3,3-heptafluoropropyl)pyrido[1,2-a][1,3,5]triazine
CID 15517155
2-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 141053130
2-propyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 141053134
ethane;4-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 178051578
4-methyl-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine
CID 178051579
3,4-Dihydro-2H-pyrido[1,2-a]pyrimidine--hydrogen bromide (1/1)
CID 71316203

Frequently Asked Questions

What is the IUPAC name of 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The IUPAC name of 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine (CID 91528254) is 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine.
What is the SMILES notation for 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The canonical SMILES for 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine is FC(F)(F)C1CCN2C=CC=CC2=N1.
What is the InChIKey of 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
The InChIKey is RUZFJIWPXVOPED-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H9F3N2/c10-9(11,12)7-4-6-14-5-2-1-3-8(14)13-7/h1-3,5,7H,4,6H2.
What are the key properties of 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine?
2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine has a molecular weight of 202.18 g/mol, XLogP of 2.11, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(trifluoromethyl)-3,4-dihydro-2H-pyrido[1,2-a]pyrimidine is sourced from PubChem (CID 91528254), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).