1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol

C12H15ClN2O2 — CID 106693891

IUPAC1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1ccc(Cl)o1
InChIInChI=1S/C12H15ClN2O2/c1-2-6-15-7-5-14-12(15)8-9(16)10-3-4-11(13)17-10/h3-5,7,9,16H,2,6,8H2,1H3
InChIKeyJFPQQXYFFLTLEL-UHFFFAOYSA-N
MW254.72 g/mol
LogP2.82
Rot. Bonds5

About 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol

1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol (PubChem CID 106693891) has the molecular formula C12H15ClN2O2 and a molecular weight of 254.72 g/mol. Its IUPAC name is 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol.

Molecular Properties

Compound Name1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
PubChem CID106693891
Molecular FormulaC12H15ClN2O2
Molecular Weight254.72 g/mol
Exact Mass254.08
IUPAC Name1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol
SMILESCCCn1ccnc1CC(O)c1ccc(Cl)o1
InChIInChI=1S/C12H15ClN2O2/c1-2-6-15-7-5-14-12(15)8-9(16)10-3-4-11(13)17-10/h3-5,7,9,16H,2,6,8H2,1H3
InChIKeyJFPQQXYFFLTLEL-UHFFFAOYSA-N
XLogP2.82
TPSA51.19 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.72
LogP ≤ 52.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(5-chloro-1-methylimidazol-2-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 114239445
1-(2-chloro-4-methylphenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 106859395
1-(1-methylpyrazol-3-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 79753116
1-(3-chloro-4-iodophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 103216978
1-(2-amino-4-chlorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79752627
1-(3-bromo-4-chlorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 115566560
1-(2,6-difluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744137
1-(3-fluorophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 79744778
1-(1-methylimidazol-4-yl)-2-(1-propylimidazol-2-yl)ethanol
CID 107978538
1-(2-amino-5-bromophenyl)-2-(1-propylimidazol-2-yl)ethanol
CID 82703490
2-(1-propylimidazol-2-yl)-1-quinoxalin-6-ylethanol
CID 79752733
1-(5-chlorofuran-2-yl)-2-(1-propylbenzimidazol-2-yl)ethanol
CID 106693864

Frequently Asked Questions

What is the IUPAC name of 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol?
The IUPAC name of 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol (CID 106693891) is 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol.
What is the SMILES notation for 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol?
The canonical SMILES for 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol is CCCn1ccnc1CC(O)c1ccc(Cl)o1.
What is the InChIKey of 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol?
The InChIKey is JFPQQXYFFLTLEL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15ClN2O2/c1-2-6-15-7-5-14-12(15)8-9(16)10-3-4-11(13)17-10/h3-5,7,9,16H,2,6,8H2,1H3.
What are the key properties of 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol?
1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol has a molecular weight of 254.72 g/mol, XLogP of 2.82, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5-chlorofuran-2-yl)-2-(1-propylimidazol-2-yl)ethanol is sourced from PubChem (CID 106693891), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).