(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone

C15H18N2O — CID 61316659

IUPAC(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone
SMILESCCn1ccnc1C(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H18N2O/c1-5-17-7-6-16-15(17)14(18)13-11(3)8-10(2)9-12(13)4/h6-9H,5H2,1-4H3
InChIKeySMVRXBQTIDOFLZ-UHFFFAOYSA-N
MW242.32 g/mol
LogP3.06
Rot. Bonds3

About (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone

(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone (PubChem CID 61316659) has the molecular formula C15H18N2O and a molecular weight of 242.32 g/mol. Its IUPAC name is (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone.

Molecular Properties

Compound Name(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone
PubChem CID61316659
Molecular FormulaC15H18N2O
Molecular Weight242.32 g/mol
Exact Mass242.14
IUPAC Name(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone
SMILESCCn1ccnc1C(=O)c1c(C)cc(C)cc1C
InChIInChI=1S/C15H18N2O/c1-5-17-7-6-16-15(17)14(18)13-11(3)8-10(2)9-12(13)4/h6-9H,5H2,1-4H3
InChIKeySMVRXBQTIDOFLZ-UHFFFAOYSA-N
XLogP3.06
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.32
LogP ≤ 53.06
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

(1-ethylimidazol-2-yl)-(2-methylphenyl)methanone
CID 61316085
(2,6-dimethylphenyl)-(1-propylimidazol-2-yl)methanone
CID 114026338
(2-amino-5-methylphenyl)-(1-ethylimidazol-2-yl)methanone
CID 65453989
(1-ethylimidazol-2-yl)-(2-fluoro-3-methylphenyl)methanone
CID 81477833
2-(1-ethylimidazol-2-yl)-2-oxoacetic acid
CID 66669024
(1-ethylimidazol-2-yl)-(1H-imidazol-2-yl)methanone
CID 18960771
1-(1-ethylimidazol-2-yl)-2-(4-methylphenyl)ethanone
CID 63975424
2-(3,4-dimethylphenyl)-1-(1-ethylimidazol-2-yl)ethanone
CID 63975634
(1-ethylimidazol-2-yl)-(6-methyl-2-pyridinyl)methanone
CID 63977122
cyclohepten-1-yl-(1-ethylimidazol-2-yl)methanone
CID 103450449
alumane;1-ethyl-2-methylimidazole;dihydrochloride
CID 173131459
1-ethyl-2-methylimidazole;sulfuric acid
CID 174953824

Frequently Asked Questions

What is the IUPAC name of (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone?
The IUPAC name of (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone (CID 61316659) is (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone.
What is the SMILES notation for (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone?
The canonical SMILES for (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone is CCn1ccnc1C(=O)c1c(C)cc(C)cc1C.
What is the InChIKey of (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone?
The InChIKey is SMVRXBQTIDOFLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O/c1-5-17-7-6-16-15(17)14(18)13-11(3)8-10(2)9-12(13)4/h6-9H,5H2,1-4H3.
What are the key properties of (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone?
(1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone has a molecular weight of 242.32 g/mol, XLogP of 3.06, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (1-ethylimidazol-2-yl)-(2,4,6-trimethylphenyl)methanone is sourced from PubChem (CID 61316659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).