2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine

C8H7F3N2O — CID 22943717

IUPAC2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine
SMILESCc1nc2c(c(C(F)(F)F)n1)CCO2
InChIInChI=1S/C8H7F3N2O/c1-4-12-6(8(9,10)11)5-2-3-14-7(5)13-4/h2-3H2,1H3
InChIKeyAGSBGAMHGZTGMD-UHFFFAOYSA-N
MW204.15 g/mol
LogP1.74
Rot. Bonds

About 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine

2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine (PubChem CID 22943717) has the molecular formula C8H7F3N2O and a molecular weight of 204.15 g/mol. Its IUPAC name is 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine.

Molecular Properties

Compound Name2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine
PubChem CID22943717
Molecular FormulaC8H7F3N2O
Molecular Weight204.15 g/mol
Exact Mass204.05
IUPAC Name2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine
SMILESCc1nc2c(c(C(F)(F)F)n1)CCO2
InChIInChI=1S/C8H7F3N2O/c1-4-12-6(8(9,10)11)5-2-3-14-7(5)13-4/h2-3H2,1H3
InChIKeyAGSBGAMHGZTGMD-UHFFFAOYSA-N
XLogP1.74
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.15
LogP ≤ 51.74
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

5-Ethyl-4-methyl-6-(2,2,3,3-tetrafluoropropoxy)pyrimidin-2-amine
CID 755539
2-Methoxy-4-methyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 46885007
5-(2,2-Difluoroethyl)-4-methoxy-6-methylpyrimidin-2-amine
CID 164908042
5-fluoro-2,4,5-trimethyl-6H-furo[2,3-d]pyrimidine
CID 176758446
5-Fluoro-2,4-dimethyl-5,6-dihydrofuro[2,3-d]pyrimidine
CID 177024349
4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
CID 4098832
4-Methyl-5-propyl-6-(2,2,2-trifluoroethoxy)pyrimidin-2-amine
CID 1383248
4-(Trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidin-2-amine
CID 82396428
2-methyl-4-(2,2,2-trifluoroethoxy)-5H,6H,7H-cyclopenta[d]pyrimidine
CID 126954711
4-(2,2-difluoroethoxy)-2-methyl-5H,6H,7H-cyclopenta[d]pyrimidine
CID 126954712
2-[2,4-Diethyl-6-(3,3,3-trifluoropropoxy)pyrimidin-5-yl]ethanamine
CID 143219252
4-Methyl-5,6-dihydrofuro[2,3-d]pyrimidin-2-yl carbamimidothioate--hydrogen bromide (1/1)
CID 12739191

Frequently Asked Questions

What is the IUPAC name of 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine?
The IUPAC name of 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine (CID 22943717) is 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine.
What is the SMILES notation for 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine?
The canonical SMILES for 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine is Cc1nc2c(c(C(F)(F)F)n1)CCO2.
What is the InChIKey of 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine?
The InChIKey is AGSBGAMHGZTGMD-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H7F3N2O/c1-4-12-6(8(9,10)11)5-2-3-14-7(5)13-4/h2-3H2,1H3.
What are the key properties of 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine?
2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine has a molecular weight of 204.15 g/mol, XLogP of 1.74, 0 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-4-(trifluoromethyl)-5,6-dihydrofuro[2,3-d]pyrimidine is sourced from PubChem (CID 22943717), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).