1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone

C17H20N2O — CID 20561718

IUPAC1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone
SMILESCc1cc(C2CCCC2)ccc1C(=O)Cn1ccnc1
InChIInChI=1S/C17H20N2O/c1-13-10-15(14-4-2-3-5-14)6-7-16(13)17(20)11-19-9-8-18-12-19/h6-10,12,14H,2-5,11H2,1H3
InChIKeyXUDIDEPBYWUBFA-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.73
Rot. Bonds4

About 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone

1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone (PubChem CID 20561718) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone.

Molecular Properties

Compound Name1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone
PubChem CID20561718
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone
SMILESCc1cc(C2CCCC2)ccc1C(=O)Cn1ccnc1
InChIInChI=1S/C17H20N2O/c1-13-10-15(14-4-2-3-5-14)6-7-16(13)17(20)11-19-9-8-18-12-19/h6-10,12,14H,2-5,11H2,1H3
InChIKeyXUDIDEPBYWUBFA-UHFFFAOYSA-N
XLogP3.73
TPSA34.89 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.73
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(4-cycloheptylphenyl)-2-imidazol-1-ylethanone
CID 54279792
(2S)-4-(4-cyclohexylphenyl)-2-imidazol-1-yl-4-oxobutanoic acid
CID 683165
methyl 4-cycloheptyl-2-methylbenzoate
CID 135331828
1-[(3-cyclohexyl-5-methylphenyl)methyl]imidazole
CID 86299944
1-[2-[4-[(dimethylamino)methyl]phenyl]piperidin-1-yl]-2-imidazol-1-ylethanone
CID 70774951
(2S)-4-(4-cyclohexylphenyl)-2-imidazol-1-yl-4-oxobutanoate
CID 7307672
1-(2-hydroxy-5-methoxyphenyl)-2-imidazol-1-ylethanone
CID 134105125
2-imidazol-1-yl-1-(4-pyridin-4-ylphenyl)ethanone
CID 14988698
2-imidazol-1-yl-1-[(3R)-3-(4-methyl-1H-pyrazol-5-yl)piperidin-1-yl]ethanone
CID 124983601
1-(2-chloro-4-cyclohexylphenyl)ethanone
CID 56998261
3-[2-(2,4-dimethylphenyl)-2-oxoethyl]pyrimidin-4-one
CID 63769538
N-[4-(2-imidazol-1-ylacetyl)phenyl]methanesulfonamide
CID 3059770

Frequently Asked Questions

What is the IUPAC name of 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone?
The IUPAC name of 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone (CID 20561718) is 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone.
What is the SMILES notation for 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone?
The canonical SMILES for 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone is Cc1cc(C2CCCC2)ccc1C(=O)Cn1ccnc1.
What is the InChIKey of 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone?
The InChIKey is XUDIDEPBYWUBFA-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-13-10-15(14-4-2-3-5-14)6-7-16(13)17(20)11-19-9-8-18-12-19/h6-10,12,14H,2-5,11H2,1H3.
What are the key properties of 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone?
1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone has a molecular weight of 268.36 g/mol, XLogP of 3.73, 4 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-cyclopentyl-2-methylphenyl)-2-imidazol-1-ylethanone is sourced from PubChem (CID 20561718), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).