2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole

C14H18N2O — CID 160651748

IUPAC2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole
SMILESCCCc1nc(-c2ccc(OC)cc2)[nH]c1C
InChIInChI=1S/C14H18N2O/c1-4-5-13-10(2)15-14(16-13)11-6-8-12(17-3)9-7-11/h6-9H,4-5H2,1-3H3,(H,15,16)
InChIKeyRKNAPHDSZAYUMX-UHFFFAOYSA-N
MW230.31 g/mol
LogP3.35
Rot. Bonds4

About 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole

2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole (PubChem CID 160651748) has the molecular formula C14H18N2O and a molecular weight of 230.31 g/mol. Its IUPAC name is 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole.

Molecular Properties

Compound Name2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole
PubChem CID160651748
Molecular FormulaC14H18N2O
Molecular Weight230.31 g/mol
Exact Mass230.14
IUPAC Name2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole
SMILESCCCc1nc(-c2ccc(OC)cc2)[nH]c1C
InChIInChI=1S/C14H18N2O/c1-4-5-13-10(2)15-14(16-13)11-6-8-12(17-3)9-7-11/h6-9H,4-5H2,1-3H3,(H,15,16)
InChIKeyRKNAPHDSZAYUMX-UHFFFAOYSA-N
XLogP3.35
TPSA37.91 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.31
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

[2-(4-methoxyphenyl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 82285142
4-(chloromethyl)-2-(4-methoxyphenyl)-5-methyl-1H-imidazole;hydrochloride
CID 22412365
[2-(4-ethoxyphenyl)-5-methyl-1H-imidazol-4-yl]methanamine
CID 82289204
4-(2-methoxyethyl)-5-methyl-2-phenyl-1H-imidazole
CID 70591932
ethyl 2-(4-methoxyphenyl)-5-methyl-1H-imidazole-4-carboxylate
CID 43445125
4-[4-(hydroxymethyl)-5-methyl-1H-imidazol-2-yl]phenol
CID 135671336
3-[2-(3-methoxyphenyl)-5-methyl-1H-imidazol-4-yl]propanoic acid
CID 82301525
5-(4-ethyl-5-methyl-1H-imidazol-2-yl)-2-methoxyaniline
CID 61394076
2-(4-methoxyphenyl)-5-methyl-4-[4-[[4-(5-methyl-4-phenyl-1H-imidazol-2-yl)phenyl]methyl]phenyl]-1H-imidazole
CID 142406883
3-[2-(4-ethylphenyl)-5-methyl-1H-imidazol-4-yl]propanoic acid
CID 82300460
2-[5-methyl-2-(4-propan-2-ylphenyl)-1H-imidazol-4-yl]ethanamine
CID 82293864
5-methyl-4-propyl-1H-imidazole-2-carbonitrile
CID 54549851

Frequently Asked Questions

What is the IUPAC name of 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole?
The IUPAC name of 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole (CID 160651748) is 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole.
What is the SMILES notation for 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole?
The canonical SMILES for 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole is CCCc1nc(-c2ccc(OC)cc2)[nH]c1C.
What is the InChIKey of 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole?
The InChIKey is RKNAPHDSZAYUMX-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H18N2O/c1-4-5-13-10(2)15-14(16-13)11-6-8-12(17-3)9-7-11/h6-9H,4-5H2,1-3H3,(H,15,16).
What are the key properties of 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole?
2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole has a molecular weight of 230.31 g/mol, XLogP of 3.35, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-methoxyphenyl)-5-methyl-4-propyl-1H-imidazole is sourced from PubChem (CID 160651748), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).