4-fluoro-6-methyl-2-propan-2-ylpyrimidine

C8H11FN2 — CID 173416420

IUPAC4-fluoro-6-methyl-2-propan-2-ylpyrimidine
SMILESCc1cc(F)nc(C(C)C)n1
InChIInChI=1S/C8H11FN2/c1-5(2)8-10-6(3)4-7(9)11-8/h4-5H,1-3H3
InChIKeyQIOQFEPQBBPLFX-UHFFFAOYSA-N
MW154.19 g/mol
LogP2.05
Rot. Bonds1

About 4-fluoro-6-methyl-2-propan-2-ylpyrimidine

4-fluoro-6-methyl-2-propan-2-ylpyrimidine (PubChem CID 173416420) has the molecular formula C8H11FN2 and a molecular weight of 154.19 g/mol. Its IUPAC name is 4-fluoro-6-methyl-2-propan-2-ylpyrimidine.

Molecular Properties

Compound Name4-fluoro-6-methyl-2-propan-2-ylpyrimidine
PubChem CID173416420
Molecular FormulaC8H11FN2
Molecular Weight154.19 g/mol
Exact Mass154.09
IUPAC Name4-fluoro-6-methyl-2-propan-2-ylpyrimidine
SMILESCc1cc(F)nc(C(C)C)n1
InChIInChI=1S/C8H11FN2/c1-5(2)8-10-6(3)4-7(9)11-8/h4-5H,1-3H3
InChIKeyQIOQFEPQBBPLFX-UHFFFAOYSA-N
XLogP2.05
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500154.19
LogP ≤ 52.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-bromo-6-methyl-2-propan-2-ylpyrimidine
CID 43517260
6-methyl-2-propan-2-ylpyrimidine-4-carbonitrile
CID 166590118
CID 174032147
CID 174032147
6-methyl-2-propan-2-yl-N-(4,4,4-trifluorobutan-2-yl)pyrimidin-4-amine
CID 113461550
2-(chloromethyl)-4-fluoro-6-methylpyrimidine
CID 155921169
2-(1-chloroethyl)-4,6-dimethylpyrimidine
CID 80655731
4-(2-bromopentan-3-yl)-6-methyl-2-propan-2-ylpyrimidine
CID 63203818
6-methyl-2-propan-2-yl-N-propylpyrimidin-4-amine
CID 43395265
3-(6-methyl-2-propan-2-ylpyrimidin-4-yl)pentan-2-amine
CID 63200525
N-(3,3-dimethylbutyl)-6-methyl-2-propan-2-ylpyrimidin-4-amine
CID 113222606
N-[(3-fluorophenyl)methyl]-6-methyl-2-propan-2-ylpyrimidin-4-amine
CID 43428292
3,6-difluoro-2-methyl-4-propan-2-ylpyridine
CID 159755748

Frequently Asked Questions

What is the IUPAC name of 4-fluoro-6-methyl-2-propan-2-ylpyrimidine?
The IUPAC name of 4-fluoro-6-methyl-2-propan-2-ylpyrimidine (CID 173416420) is 4-fluoro-6-methyl-2-propan-2-ylpyrimidine.
What is the SMILES notation for 4-fluoro-6-methyl-2-propan-2-ylpyrimidine?
The canonical SMILES for 4-fluoro-6-methyl-2-propan-2-ylpyrimidine is Cc1cc(F)nc(C(C)C)n1.
What is the InChIKey of 4-fluoro-6-methyl-2-propan-2-ylpyrimidine?
The InChIKey is QIOQFEPQBBPLFX-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11FN2/c1-5(2)8-10-6(3)4-7(9)11-8/h4-5H,1-3H3.
What are the key properties of 4-fluoro-6-methyl-2-propan-2-ylpyrimidine?
4-fluoro-6-methyl-2-propan-2-ylpyrimidine has a molecular weight of 154.19 g/mol, XLogP of 2.05, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-fluoro-6-methyl-2-propan-2-ylpyrimidine is sourced from PubChem (CID 173416420), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).