5-[2-(4-propylphenoxy)ethyl]-1H-imidazole

C14H18N2O — CID 10376572

IUPAC5-[2-(4-propylphenoxy)ethyl]-1H-imidazole
SMILESCCCc1ccc(OCCc2cnc[nH]2)cc1
InChIInChI=1S/C14H18N2O/c1-2-3-12-4-6-14(7-5-12)17-9-8-13-10-15-11-16-13/h4-7,10-11H,2-3,8-9H2,1H3,(H,15,16)
InChIKeyKSAZIDHNIGOAOZ-UHFFFAOYSA-N
MW230.31 g/mol
LogP2.98
Rot. Bonds6

About 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole

5-[2-(4-propylphenoxy)ethyl]-1H-imidazole (PubChem CID 10376572) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole.

Molecular Properties

Compound Name5-[2-(4-propylphenoxy)ethyl]-1H-imidazole
PubChem CID10376572
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name5-[2-(4-propylphenoxy)ethyl]-1H-imidazole
SMILESCCCc1ccc(OCCc2cnc[nH]2)cc1
InChIInChI=1S/C14H18N2O/c1-2-3-12-4-6-14(7-5-12)17-9-8-13-10-15-11-16-13/h4-7,10-11H,2-3,8-9H2,1H3,(H,15,16)
InChIKeyKSAZIDHNIGOAOZ-UHFFFAOYSA-N
XLogP2.98
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 52.98
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

5-[2-(4-methylphenoxy)ethyl]-1H-imidazole
CID 10536116
[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]methanethiol
CID 87662551
5-[2-(4-methoxyphenyl)ethyl]-1H-imidazole
CID 91318795
1-(2-phenylethoxy)-4-propylbenzene
CID 70483798
4-[3-(1H-imidazol-5-yl)propoxy]thiobenzaldehyde
CID 21193608
butane;1-(2-phenylethoxy)-4-propylbenzene
CID 142957775
1-nonoxy-4-propylbenzene
CID 118632119
4-hydroxy-4-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]butan-2-one
CID 69022253
4-[3-(4-propylphenoxy)propoxy]aniline
CID 62548380
1-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]imidazole
CID 21193484
3-[4-[3-(1H-imidazol-5-yl)propoxy]phenyl]-5-methyl-1,2,4-oxadiazole
CID 21193526
5-hexyl-1H-imidazole
CID 14225142

Frequently Asked Questions

What is the IUPAC name of 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole?
The IUPAC name of 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole (CID 10376572) is 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole.
What is the SMILES notation for 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole?
The canonical SMILES for 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole is CCCc1ccc(OCCc2cnc[nH]2)cc1.
What is the InChIKey of 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole?
The InChIKey is KSAZIDHNIGOAOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-2-3-12-4-6-14(7-5-12)17-9-8-13-10-15-11-16-13/h4-7,10-11H,2-3,8-9H2,1H3,(H,15,16).
What are the key properties of 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole?
5-[2-(4-propylphenoxy)ethyl]-1H-imidazole has a molecular weight of 230.31 g/mol, XLogP of 2.98, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[2-(4-propylphenoxy)ethyl]-1H-imidazole is sourced from PubChem (CID 10376572), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).