2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine

C10H10ClF3N2O — CID 114561964

IUPAC2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine
SMILESFC(F)(F)c1cc(OC2CCCC2)nc(Cl)n1
InChIInChI=1S/C10H10ClF3N2O/c11-9-15-7(10(12,13)14)5-8(16-9)17-6-3-1-2-4-6/h5-6H,1-4H2
InChIKeyRGCHRMCNPIPMMI-UHFFFAOYSA-N
MW266.65 g/mol
LogP3.47
Rot. Bonds2

About 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine

2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine (PubChem CID 114561964) has the molecular formula C10H10ClF3N2O and a molecular weight of 266.65 g/mol. Its IUPAC name is 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine.

Molecular Properties

Compound Name2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine
PubChem CID114561964
Molecular FormulaC10H10ClF3N2O
Molecular Weight266.65 g/mol
Exact Mass266.04
IUPAC Name2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine
SMILESFC(F)(F)c1cc(OC2CCCC2)nc(Cl)n1
InChIInChI=1S/C10H10ClF3N2O/c11-9-15-7(10(12,13)14)5-8(16-9)17-6-3-1-2-4-6/h5-6H,1-4H2
InChIKeyRGCHRMCNPIPMMI-UHFFFAOYSA-N
XLogP3.47
TPSA35.01 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.65
LogP ≤ 53.47
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine?
The IUPAC name of 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine (CID 114561964) is 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine.
What is the SMILES notation for 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine?
The canonical SMILES for 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine is FC(F)(F)c1cc(OC2CCCC2)nc(Cl)n1.
What is the InChIKey of 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine?
The InChIKey is RGCHRMCNPIPMMI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H10ClF3N2O/c11-9-15-7(10(12,13)14)5-8(16-9)17-6-3-1-2-4-6/h5-6H,1-4H2.
What are the key properties of 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine?
2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine has a molecular weight of 266.65 g/mol, XLogP of 3.47, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-chloro-4-cyclopentyloxy-6-(trifluoromethyl)pyrimidine is sourced from PubChem (CID 114561964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).