cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone

C18H26O2 — CID 82552755

IUPACcyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
SMILESCOc1cc(C)c(C(=O)C2CCCCC2)cc1C(C)C
InChIInChI=1S/C18H26O2/c1-12(2)15-11-16(13(3)10-17(15)20-4)18(19)14-8-6-5-7-9-14/h10-12,14H,5-9H2,1-4H3
InChIKeyDJJNIZNLDPAZRM-UHFFFAOYSA-N
MW274.40 g/mol
LogP4.89
Rot. Bonds4

About cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone

cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone (PubChem CID 82552755) has the molecular formula C18H26O2 and a molecular weight of 274.40 g/mol. Its IUPAC name is cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone.

Molecular Properties

Compound Namecyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
PubChem CID82552755
Molecular FormulaC18H26O2
Molecular Weight274.40 g/mol
Exact Mass274.19
IUPAC Namecyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
SMILESCOc1cc(C)c(C(=O)C2CCCCC2)cc1C(C)C
InChIInChI=1S/C18H26O2/c1-12(2)15-11-16(13(3)10-17(15)20-4)18(19)14-8-6-5-7-9-14/h10-12,14H,5-9H2,1-4H3
InChIKeyDJJNIZNLDPAZRM-UHFFFAOYSA-N
XLogP4.89
TPSA26.30 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 54.89
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

cyclohexyl-(4-methoxy-2,5-dimethylphenyl)methanone
CID 82049373
azetidin-3-yl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
CID 116916740
cyclohexyl-(2-methoxy-4,5-dimethylphenyl)methanone
CID 82049372
2-(cyclopropylamino)-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)ethanone
CID 94978847
cyclobutyl-(2,4,5-trimethylphenyl)methanone
CID 64989834
1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)-3-methylbutan-1-one
CID 94978273
(5-chloro-2-methoxyphenyl)-cycloheptylmethanone
CID 65399771
3-chloro-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propan-1-one
CID 94978468
(1-aminocyclopropyl)-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone
CID 116924291
3-chloro-1-(4-methoxy-2-methyl-5-propan-2-ylphenyl)propane-1,2-dione
CID 116822637
4-methoxy-N',2-dimethyl-5-propan-2-ylbenzohydrazide
CID 116846868
cyclohexyl-(2-propan-2-ylphenyl)methanone
CID 146007151

Frequently Asked Questions

What is the IUPAC name of cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone?
The IUPAC name of cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone (CID 82552755) is cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone.
What is the SMILES notation for cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone?
The canonical SMILES for cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone is COc1cc(C)c(C(=O)C2CCCCC2)cc1C(C)C.
What is the InChIKey of cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone?
The InChIKey is DJJNIZNLDPAZRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H26O2/c1-12(2)15-11-16(13(3)10-17(15)20-4)18(19)14-8-6-5-7-9-14/h10-12,14H,5-9H2,1-4H3.
What are the key properties of cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone?
cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone has a molecular weight of 274.40 g/mol, XLogP of 4.89, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for cyclohexyl-(4-methoxy-2-methyl-5-propan-2-ylphenyl)methanone is sourced from PubChem (CID 82552755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).