4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine

C10H9ClN2O — CID 43557912

IUPAC4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine
SMILESCCc1cc(Cl)nc(-c2ccco2)n1
InChIInChI=1S/C10H9ClN2O/c1-2-7-6-9(11)13-10(12-7)8-4-3-5-14-8/h3-6H,2H2,1H3
InChIKeyVPLAUGAPZLJHIG-UHFFFAOYSA-N
MW208.65 g/mol
LogP2.95
Rot. Bonds2

About 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine

4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine (PubChem CID 43557912) has the molecular formula C10H9ClN2O and a molecular weight of 208.65 g/mol. Its IUPAC name is 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine.

Molecular Properties

Compound Name4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine
PubChem CID43557912
Molecular FormulaC10H9ClN2O
Molecular Weight208.65 g/mol
Exact Mass208.04
IUPAC Name4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine
SMILESCCc1cc(Cl)nc(-c2ccco2)n1
InChIInChI=1S/C10H9ClN2O/c1-2-7-6-9(11)13-10(12-7)8-4-3-5-14-8/h3-6H,2H2,1H3
InChIKeyVPLAUGAPZLJHIG-UHFFFAOYSA-N
XLogP2.95
TPSA38.92 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.65
LogP ≤ 52.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-6-ethyl-2-(2-methylpyrazol-3-yl)pyrimidine
CID 114553959
6-ethyl-4-(furan-2-yl)-2,3-dimethylpyridine
CID 608303
N-[[2-(furan-2-yl)-6-methylpyrimidin-4-yl]methyl]ethanamine
CID 62746211
2-(3-bromothiophen-2-yl)-4-chloro-6-ethylpyrimidine
CID 115380801
4-chloro-2-(5-ethylfuran-2-yl)-6-propylpyrimidine
CID 62345963
2-(furan-2-yl)-6-(methoxymethyl)pyrimidin-4-amine
CID 62320056
5-(chloromethyl)-3-(furan-2-yl)-1H-1,2,4-triazole
CID 79600359
4-chloro-2,6-diethylpyrimidine
CID 43557605
2-[4,6-diethyl-2-(furan-2-yl)pyrimidin-5-yl]-N-methylethanamine
CID 79219302
N-ethyl-2-(furan-2-yl)-6-methylpyrimidin-4-amine
CID 62201507
5-chloro-3-(furan-2-yl)-1,2,4-thiadiazole
CID 54258007
2-chloro-4-(furan-2-yl)-6-methylsulfanyl-1,3,5-triazine
CID 12870888

Frequently Asked Questions

What is the IUPAC name of 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine?
The IUPAC name of 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine (CID 43557912) is 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine.
What is the SMILES notation for 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine?
The canonical SMILES for 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine is CCc1cc(Cl)nc(-c2ccco2)n1.
What is the InChIKey of 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine?
The InChIKey is VPLAUGAPZLJHIG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9ClN2O/c1-2-7-6-9(11)13-10(12-7)8-4-3-5-14-8/h3-6H,2H2,1H3.
What are the key properties of 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine?
4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine has a molecular weight of 208.65 g/mol, XLogP of 2.95, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-chloro-6-ethyl-2-(furan-2-yl)pyrimidine is sourced from PubChem (CID 43557912), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).