4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane

C10H16F2N2 — CID 176699217

IUPAC4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane
SMILESCC.CCc1cnc(C)nc1C(F)F
InChIInChI=1S/C8H10F2N2.C2H6/c1-3-6-4-11-5(2)12-7(6)8(9)10;1-2/h4,8H,3H2,1-2H3;1-2H3
InChIKeyNSFDTLCDKNNYDV-UHFFFAOYSA-N
MW202.25 g/mol
LogP3.31
Rot. Bonds2

About 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane

4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane (PubChem CID 176699217) has the molecular formula C10H16F2N2 and a molecular weight of 202.25 g/mol. Its IUPAC name is 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane.

Molecular Properties

Compound Name4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane
PubChem CID176699217
Molecular FormulaC10H16F2N2
Molecular Weight202.25 g/mol
Exact Mass202.13
IUPAC Name4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane
SMILESCC.CCc1cnc(C)nc1C(F)F
InChIInChI=1S/C8H10F2N2.C2H6/c1-3-6-4-11-5(2)12-7(6)8(9)10;1-2/h4,8H,3H2,1-2H3;1-2H3
InChIKeyNSFDTLCDKNNYDV-UHFFFAOYSA-N
XLogP3.31
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500202.25
LogP ≤ 53.31
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

5-ethyl-2-methylpyrimidin-4-amine
CID 22978191
[4-(difluoromethyl)-2-ethylpyrimidin-5-yl]methanol
CID 130482994
2-(difluoromethyl)-5-ethyl-4-methylpyridine
CID 176699020
2-(5-ethyl-2-methylpyrimidin-4-yl)ethanethiol
CID 142533287
ethane;5-fluoro-2-methyl-4-propan-2-ylpyrimidine
CID 177328154
5-(bromomethyl)-2-(difluoromethyl)-3,4-dimethylpyridine
CID 130101296
2-(2-methyl-4-propan-2-ylpyrimidin-5-yl)acetonitrile
CID 84766967
2-(difluoromethyl)-5-ethyl-4-fluoropyridine
CID 176699553
5-bromo-4-ethyl-2-methylpyrimidine;ethane
CID 162730245
[4-(difluoromethyl)-2-(5-methylpyrimidin-2-yl)pyrimidin-5-yl]methanamine
CID 114206164
5-(chloromethyl)-4-(difluoromethyl)-2-(5-methylpyrimidin-2-yl)pyrimidine
CID 114205496
2-methyl-4,5-di(propan-2-yl)pyrimidine
CID 59058770

Frequently Asked Questions

What is the IUPAC name of 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane?
The IUPAC name of 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane (CID 176699217) is 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane.
What is the SMILES notation for 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane?
The canonical SMILES for 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane is CC.CCc1cnc(C)nc1C(F)F.
What is the InChIKey of 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane?
The InChIKey is NSFDTLCDKNNYDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10F2N2.C2H6/c1-3-6-4-11-5(2)12-7(6)8(9)10;1-2/h4,8H,3H2,1-2H3;1-2H3.
What are the key properties of 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane?
4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane has a molecular weight of 202.25 g/mol, XLogP of 3.31, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(difluoromethyl)-5-ethyl-2-methylpyrimidine;ethane is sourced from PubChem (CID 176699217), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).