4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine

C10H15FN2 — CID 144787122

IUPAC4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine
SMILESCC(C)c1cc(C(C)(C)F)ncn1
InChIInChI=1S/C10H15FN2/c1-7(2)8-5-9(10(3,4)11)13-6-12-8/h5-7H,1-4H3
InChIKeyWGEHZFZQXWLMFP-UHFFFAOYSA-N
MW182.24 g/mol
LogP2.80
Rot. Bonds2

About 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine

4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine (PubChem CID 144787122) has the molecular formula C10H15FN2 and a molecular weight of 182.24 g/mol. Its IUPAC name is 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine.

Molecular Properties

Compound Name4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine
PubChem CID144787122
Molecular FormulaC10H15FN2
Molecular Weight182.24 g/mol
Exact Mass182.12
IUPAC Name4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine
SMILESCC(C)c1cc(C(C)(C)F)ncn1
InChIInChI=1S/C10H15FN2/c1-7(2)8-5-9(10(3,4)11)13-6-12-8/h5-7H,1-4H3
InChIKeyWGEHZFZQXWLMFP-UHFFFAOYSA-N
XLogP2.80
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500182.24
LogP ≤ 52.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine?
The IUPAC name of 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine (CID 144787122) is 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine.
What is the SMILES notation for 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine?
The canonical SMILES for 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine is CC(C)c1cc(C(C)(C)F)ncn1.
What is the InChIKey of 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine?
The InChIKey is WGEHZFZQXWLMFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15FN2/c1-7(2)8-5-9(10(3,4)11)13-6-12-8/h5-7H,1-4H3.
What are the key properties of 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine?
4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine has a molecular weight of 182.24 g/mol, XLogP of 2.80, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-fluoropropan-2-yl)-6-propan-2-ylpyrimidine is sourced from PubChem (CID 144787122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).