[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol

C16H15ClN2O3 — CID 70760130

IUPAC[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol
SMILESOCc1ccc(-c2nccn2CCOc2ccccc2Cl)o1
InChIInChI=1S/C16H15ClN2O3/c17-13-3-1-2-4-14(13)21-10-9-19-8-7-18-16(19)15-6-5-12(11-20)22-15/h1-8,20H,9-11H2
InChIKeyFJTQUHDQEVGZHJ-UHFFFAOYSA-N
MW318.76 g/mol
LogP3.37
Rot. Bonds6

About [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol

[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol (PubChem CID 70760130) has the molecular formula C16H15ClN2O3 and a molecular weight of 318.76 g/mol. Its IUPAC name is [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol.

Molecular Properties

Compound Name[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol
PubChem CID70760130
Molecular FormulaC16H15ClN2O3
Molecular Weight318.76 g/mol
Exact Mass318.08
IUPAC Name[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol
SMILESOCc1ccc(-c2nccn2CCOc2ccccc2Cl)o1
InChIInChI=1S/C16H15ClN2O3/c17-13-3-1-2-4-14(13)21-10-9-19-8-7-18-16(19)15-6-5-12(11-20)22-15/h1-8,20H,9-11H2
InChIKeyFJTQUHDQEVGZHJ-UHFFFAOYSA-N
XLogP3.37
TPSA60.42 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500318.76
LogP ≤ 53.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-methoxyethyl)-2-(5-propylfuran-2-yl)imidazole
CID 56742593
[5-[1-(2-methoxy-2-thiophen-2-ylethyl)imidazol-2-yl]furan-2-yl]methanol
CID 56866506
[5-(2-chlorophenyl)furan-2-yl]methanol
CID 4796268
2-(2-chlorophenoxy)-N-[5-[5-(hydroxymethyl)furan-2-yl]-2-methylphenyl]acetamide
CID 28676829
2-[1-[2-(2-chlorophenoxy)ethyl]triazol-4-yl]ethanol
CID 55066947
2-(5-ethylfuran-2-yl)-1-(2-imidazol-1-ylethyl)imidazole
CID 56750457
[5-[1-[(3S)-1-benzylpyrrolidin-3-yl]imidazol-2-yl]furan-2-yl]methanol
CID 95555840
2-(2-methylimidazol-1-yl)ethyl 2-(2-aminophenoxy)acetate
CID 61493883
3-chloro-4-[2-(2-methylimidazol-1-yl)ethoxy]aniline
CID 54961449
[2-chloro-6-(2-imidazol-1-ylethoxy)phenyl]methanol
CID 114320427
(1R)-2-[2-[5-(2-chlorophenyl)furan-2-yl]imidazol-1-yl]-1-pyridin-3-ylethanol
CID 95216864
bis[2-(2-chlorophenoxy)ethyl] oxalate
CID 68775442

Frequently Asked Questions

What is the IUPAC name of [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol?
The IUPAC name of [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol (CID 70760130) is [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol.
What is the SMILES notation for [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol?
The canonical SMILES for [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol is OCc1ccc(-c2nccn2CCOc2ccccc2Cl)o1.
What is the InChIKey of [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol?
The InChIKey is FJTQUHDQEVGZHJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H15ClN2O3/c17-13-3-1-2-4-14(13)21-10-9-19-8-7-18-16(19)15-6-5-12(11-20)22-15/h1-8,20H,9-11H2.
What are the key properties of [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol?
[5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol has a molecular weight of 318.76 g/mol, XLogP of 3.37, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [5-[1-[2-(2-chlorophenoxy)ethyl]imidazol-2-yl]furan-2-yl]methanol is sourced from PubChem (CID 70760130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).