1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole

C17H18N2O2 — CID 71548090

IUPAC1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole
SMILESCCC(c1ccc(-c2ccc(OC)cc2)o1)n1ccnc1
InChIInChI=1S/C17H18N2O2/c1-3-15(19-11-10-18-12-19)17-9-8-16(21-17)13-4-6-14(20-2)7-5-13/h4-12,15H,3H2,1-2H3
InChIKeyXSAKLCFSBVQJJM-UHFFFAOYSA-N
MW282.34 g/mol
LogP4.15
Rot. Bonds5

About 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole

1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole (PubChem CID 71548090) has the molecular formula C17H18N2O2 and a molecular weight of 282.34 g/mol. Its IUPAC name is 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole.

Molecular Properties

Compound Name1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole
PubChem CID71548090
Molecular FormulaC17H18N2O2
Molecular Weight282.34 g/mol
Exact Mass282.14
IUPAC Name1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole
SMILESCCC(c1ccc(-c2ccc(OC)cc2)o1)n1ccnc1
InChIInChI=1S/C17H18N2O2/c1-3-15(19-11-10-18-12-19)17-9-8-16(21-17)13-4-6-14(20-2)7-5-13/h4-12,15H,3H2,1-2H3
InChIKeyXSAKLCFSBVQJJM-UHFFFAOYSA-N
XLogP4.15
TPSA40.19 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.34
LogP ≤ 54.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(1S)-1,2-bis(4-methoxyphenyl)ethyl]imidazole
CID 57402760
2-(4-methoxyphenyl)-5-methylfuran
CID 11171456
2-(1-imidazol-1-ylpropyl)-5-(2-methoxyphenyl)pyridine
CID 71548383
5-(1-imidazol-1-ylpropyl)-2-(6-methoxy-3-pyridinyl)-1,3-thiazole
CID 71548378
1-[2-(4-methoxyphenoxy)ethyl]imidazole
CID 868397
6-(1-imidazol-1-ylpropyl)-1,3,5-triazine-2,4-diamine
CID 22022641
1-[(1R)-1-[(1R)-1,2-bis(4-methoxyphenyl)ethoxy]ethyl]imidazole
CID 95988616
2-(1-imidazol-1-ylpropyl)-5-[4-(methoxymethoxymethyl)phenyl]pyridine
CID 71547905
4-[4-(1-imidazol-1-ylpropyl)phenyl]-2-methylphenol
CID 42642929
1-ethyl-4-[[2-[5-(4-methoxyphenyl)furan-2-yl]imidazol-1-yl]methyl]imidazole
CID 154820768
1-[1-(4-methylphenyl)butyl]imidazole
CID 90765635
5-(1-imidazol-1-ylpropyl)-2-phenylpyridine
CID 57329941

Frequently Asked Questions

What is the IUPAC name of 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole?
The IUPAC name of 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole (CID 71548090) is 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole.
What is the SMILES notation for 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole?
The canonical SMILES for 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole is CCC(c1ccc(-c2ccc(OC)cc2)o1)n1ccnc1.
What is the InChIKey of 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole?
The InChIKey is XSAKLCFSBVQJJM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2/c1-3-15(19-11-10-18-12-19)17-9-8-16(21-17)13-4-6-14(20-2)7-5-13/h4-12,15H,3H2,1-2H3.
What are the key properties of 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole?
1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole has a molecular weight of 282.34 g/mol, XLogP of 4.15, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[1-[5-(4-methoxyphenyl)furan-2-yl]propyl]imidazole is sourced from PubChem (CID 71548090), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).