2-(difluoromethyl)-5-methylpyrimidine;ethane

C10H18F2N2 — CID 170582864

IUPAC2-(difluoromethyl)-5-methylpyrimidine;ethane
SMILESCC.CC.Cc1cnc(C(F)F)nc1
InChIInChI=1S/C6H6F2N2.2C2H6/c1-4-2-9-6(5(7)8)10-3-4;2*1-2/h2-3,5H,1H3;2*1-2H3
InChIKeyGUEPDZMCHBAHCR-UHFFFAOYSA-N
MW204.26 g/mol
LogP3.78
Rot. Bonds1

About 2-(difluoromethyl)-5-methylpyrimidine;ethane

2-(difluoromethyl)-5-methylpyrimidine;ethane (PubChem CID 170582864) has the molecular formula C10H18F2N2 and a molecular weight of 204.26 g/mol. Its IUPAC name is 2-(difluoromethyl)-5-methylpyrimidine;ethane.

Molecular Properties

Compound Name2-(difluoromethyl)-5-methylpyrimidine;ethane
PubChem CID170582864
Molecular FormulaC10H18F2N2
Molecular Weight204.26 g/mol
Exact Mass204.14
IUPAC Name2-(difluoromethyl)-5-methylpyrimidine;ethane
SMILESCC.CC.Cc1cnc(C(F)F)nc1
InChIInChI=1S/C6H6F2N2.2C2H6/c1-4-2-9-6(5(7)8)10-3-4;2*1-2/h2-3,5H,1H3;2*1-2H3
InChIKeyGUEPDZMCHBAHCR-UHFFFAOYSA-N
XLogP3.78
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.26
LogP ≤ 53.78
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-methyl-2-pentan-3-ylpyrimidine
CID 91611404
(1R)-1-(5-methylpyrimidin-2-yl)ethane-1,2-diol
CID 134543108
1-(5-methylpyrimidin-2-yl)ethane-1,2-diol
CID 122701977
2-(difluoromethyl)-5-(4,4-difluoro-1-methylcyclohexyl)pyrimidine
CID 141403698
2-(1,1-difluoroethyl)-5-methylpyrimidine;ethane
CID 145136469
1-(5-methylpyrimidin-2-yl)propylhydrazine
CID 105261553
(2,3-difluoro-4-methylphenyl)-(5-methylpyrimidin-2-yl)methanamine
CID 107513751
2,5-dimethylpyrimidine;methanamine
CID 161178837
5-methylpyrimidin-2-amine
CID 12999933
(2R)-3-cyclopropyl-2-[2-(difluoromethyl)pyrimidin-5-yl]-2-methylpropan-1-amine
CID 129409399
2-(1-fluoroethyl)-5-methylpyridine
CID 126491448
5-(chloromethyl)-4-(difluoromethyl)-2-(5-methylpyrimidin-2-yl)pyrimidine
CID 114205496

Frequently Asked Questions

What is the IUPAC name of 2-(difluoromethyl)-5-methylpyrimidine;ethane?
The IUPAC name of 2-(difluoromethyl)-5-methylpyrimidine;ethane (CID 170582864) is 2-(difluoromethyl)-5-methylpyrimidine;ethane.
What is the SMILES notation for 2-(difluoromethyl)-5-methylpyrimidine;ethane?
The canonical SMILES for 2-(difluoromethyl)-5-methylpyrimidine;ethane is CC.CC.Cc1cnc(C(F)F)nc1.
What is the InChIKey of 2-(difluoromethyl)-5-methylpyrimidine;ethane?
The InChIKey is GUEPDZMCHBAHCR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H6F2N2.2C2H6/c1-4-2-9-6(5(7)8)10-3-4;2*1-2/h2-3,5H,1H3;2*1-2H3.
What are the key properties of 2-(difluoromethyl)-5-methylpyrimidine;ethane?
2-(difluoromethyl)-5-methylpyrimidine;ethane has a molecular weight of 204.26 g/mol, XLogP of 3.78, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(difluoromethyl)-5-methylpyrimidine;ethane is sourced from PubChem (CID 170582864), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).