2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole

C15H18N2O — CID 89441655

IUPAC2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole
SMILESC=C(Cc1nccn1C)c1cc(C)ccc1OC
InChIInChI=1S/C15H18N2O/c1-11-5-6-14(18-4)13(9-11)12(2)10-15-16-7-8-17(15)3/h5-9H,2,10H2,1,3-4H3
InChIKeySVEHVYPTMHTBFP-UHFFFAOYSA-N
MW242.32 g/mol
LogP2.99
Rot. Bonds4

About 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole

2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole (PubChem CID 89441655) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole.

Molecular Properties

Compound Name2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole
PubChem CID89441655
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole
SMILESC=C(Cc1nccn1C)c1cc(C)ccc1OC
InChIInChI=1S/C15H18N2O/c1-11-5-6-14(18-4)13(9-11)12(2)10-15-16-7-8-17(15)3/h5-9H,2,10H2,1,3-4H3
InChIKeySVEHVYPTMHTBFP-UHFFFAOYSA-N
XLogP2.99
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(2-methoxy-4-methylphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 106790241
1-(2-methoxy-5-methylphenyl)-3-(1-methylimidazol-2-yl)propan-1-amine
CID 105049774
1-(2-fluoro-4-methylphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784443
potassium trifluoro-[5-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]boranuide
CID 114528517
1-(4-methoxy-3-methylphenyl)-3-(1-methylimidazol-2-yl)propan-1-ol
CID 114529108
N-[(5-chloro-2-methoxyphenyl)methyl]-2-(1-methylimidazol-2-yl)ethanamine
CID 61212601
1-[4,5-dimethoxy-2-[(1-methylimidazol-2-yl)methyl]phenyl]-N-methylmethanamine
CID 79738334
1-(4-fluoro-3-methoxyphenyl)-2-(1-methylimidazol-2-yl)ethanone
CID 115784488
(1R)-1-[4-methyl-2-[2-(1-methylimidazol-2-yl)ethoxy]phenyl]ethanol
CID 104934285
4-methyl-2-[(1-methylimidazol-2-yl)methoxy]aniline
CID 39201519
[1-[(2-methoxy-5-methylphenyl)methyl]imidazol-2-yl]methanamine
CID 62221952
N-[2-(2-methoxy-4-methylphenoxy)ethyl]-N-[(1-methylimidazol-2-yl)methyl]cyclopropanamine
CID 91841422

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole?
The IUPAC name of 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole (CID 89441655) is 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole.
What is the SMILES notation for 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole?
The canonical SMILES for 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole is C=C(Cc1nccn1C)c1cc(C)ccc1OC.
What is the InChIKey of 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole?
The InChIKey is SVEHVYPTMHTBFP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-11-5-6-14(18-4)13(9-11)12(2)10-15-16-7-8-17(15)3/h5-9H,2,10H2,1,3-4H3.
What are the key properties of 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole?
2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole has a molecular weight of 242.32 g/mol, XLogP of 2.99, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-methoxy-5-methylphenyl)prop-2-enyl]-1-methylimidazole is sourced from PubChem (CID 89441655), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).