4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine

C10H15FN2O — CID 59096541

IUPAC4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine
SMILESCOCc1nc(C)cc(C(C)(C)F)n1
InChIInChI=1S/C10H15FN2O/c1-7-5-8(10(2,3)11)13-9(12-7)6-14-4/h5H,6H2,1-4H3
InChIKeySDHCXBCAJJMMBD-UHFFFAOYSA-N
MW198.24 g/mol
LogP2.14
Rot. Bonds3

About 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine

4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine (PubChem CID 59096541) has the molecular formula C10H15FN2O and a molecular weight of 198.24 g/mol. Its IUPAC name is 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine.

Molecular Properties

Compound Name4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine
PubChem CID59096541
Molecular FormulaC10H15FN2O
Molecular Weight198.24 g/mol
Exact Mass198.12
IUPAC Name4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine
SMILESCOCc1nc(C)cc(C(C)(C)F)n1
InChIInChI=1S/C10H15FN2O/c1-7-5-8(10(2,3)11)13-9(12-7)6-14-4/h5H,6H2,1-4H3
InChIKeySDHCXBCAJJMMBD-UHFFFAOYSA-N
XLogP2.14
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500198.24
LogP ≤ 52.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine?
The IUPAC name of 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine (CID 59096541) is 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine.
What is the SMILES notation for 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine?
The canonical SMILES for 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine is COCc1nc(C)cc(C(C)(C)F)n1.
What is the InChIKey of 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine?
The InChIKey is SDHCXBCAJJMMBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2O/c1-7-5-8(10(2,3)11)13-9(12-7)6-14-4/h5H,6H2,1-4H3.
What are the key properties of 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine?
4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine has a molecular weight of 198.24 g/mol, XLogP of 2.14, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoropropan-2-yl)-2-(methoxymethyl)-6-methylpyrimidine is sourced from PubChem (CID 59096541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).