2,4-dichloro-5-(2-fluoroethyl)pyrimidine

C6H5Cl2FN2 — CID 83854274

IUPAC2,4-dichloro-5-(2-fluoroethyl)pyrimidine
SMILESFCCc1cnc(Cl)nc1Cl
InChIInChI=1S/C6H5Cl2FN2/c7-5-4(1-2-9)3-10-6(8)11-5/h3H,1-2H2
InChIKeyLPUFTNHIMYBCOR-UHFFFAOYSA-N
MW195.02 g/mol
LogP2.30
Rot. Bonds2

About 2,4-dichloro-5-(2-fluoroethyl)pyrimidine

2,4-dichloro-5-(2-fluoroethyl)pyrimidine (PubChem CID 83854274) has the molecular formula C6H5Cl2FN2 and a molecular weight of 195.02 g/mol. Its IUPAC name is 2,4-dichloro-5-(2-fluoroethyl)pyrimidine.

Molecular Properties

Compound Name2,4-dichloro-5-(2-fluoroethyl)pyrimidine
PubChem CID83854274
Molecular FormulaC6H5Cl2FN2
Molecular Weight195.02 g/mol
Exact Mass193.98
IUPAC Name2,4-dichloro-5-(2-fluoroethyl)pyrimidine
SMILESFCCc1cnc(Cl)nc1Cl
InChIInChI=1S/C6H5Cl2FN2/c7-5-4(1-2-9)3-10-6(8)11-5/h3H,1-2H2
InChIKeyLPUFTNHIMYBCOR-UHFFFAOYSA-N
XLogP2.30
TPSA25.78 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.02
LogP ≤ 52.30
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(2,4-dichloropyrimidin-5-yl)methyl]propan-2-amine
CID 53385528
N-[(2,4-dichloropyrimidin-5-yl)methyl]cyclopropanamine
CID 53385527
2-(4-chloro-2-methylsulfanylpyrimidin-5-yl)ethanamine
CID 83852150
2,4-dichloro-5-(pyrrolidin-3-yloxymethyl)pyrimidine;hydrochloride
CID 71640385
2,4-dichloro-5-(piperidin-4-yloxymethyl)pyrimidine
CID 71640390
2-[(2,4-dichloropyrimidin-5-yl)methyl]isoindole-1,3-dione
CID 118626942
3-[(2,4-dichloropyrimidin-5-yl)methoxy]bicyclo[1.1.1]pentane-1-carboxylic acid
CID 174211791
1-[(2,4-dichloropyrimidin-5-yl)methyl]pyrrolidin-2-one
CID 170969547
2-(4-chloro-2-methylsulfonylpyrimidin-5-yl)ethanamine
CID 83852624
1-(2,4-dichloropyrimidin-5-yl)-4,4,4-trifluorobutan-1-one
CID 161476280
2,4-dichloro-5-[[(2R)-2-methylpyrrolidin-1-yl]methyl]pyrimidine
CID 118943869
1-[1-[(2,4-dichloropyrimidin-5-yl)methyl]piperidin-4-yl]oxy-3-fluoropropan-2-ol
CID 170969749

Frequently Asked Questions

What is the IUPAC name of 2,4-dichloro-5-(2-fluoroethyl)pyrimidine?
The IUPAC name of 2,4-dichloro-5-(2-fluoroethyl)pyrimidine (CID 83854274) is 2,4-dichloro-5-(2-fluoroethyl)pyrimidine.
What is the SMILES notation for 2,4-dichloro-5-(2-fluoroethyl)pyrimidine?
The canonical SMILES for 2,4-dichloro-5-(2-fluoroethyl)pyrimidine is FCCc1cnc(Cl)nc1Cl.
What is the InChIKey of 2,4-dichloro-5-(2-fluoroethyl)pyrimidine?
The InChIKey is LPUFTNHIMYBCOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H5Cl2FN2/c7-5-4(1-2-9)3-10-6(8)11-5/h3H,1-2H2.
What are the key properties of 2,4-dichloro-5-(2-fluoroethyl)pyrimidine?
2,4-dichloro-5-(2-fluoroethyl)pyrimidine has a molecular weight of 195.02 g/mol, XLogP of 2.30, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,4-dichloro-5-(2-fluoroethyl)pyrimidine is sourced from PubChem (CID 83854274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).