1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene

C15H20O — CID 175668823

IUPAC1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene
SMILESCCOc1ccccc1C1=CCC(C)CC1
InChIInChI=1S/C15H20O/c1-3-16-15-7-5-4-6-14(15)13-10-8-12(2)9-11-13/h4-7,10,12H,3,8-9,11H2,1-2H3
InChIKeyLXXBVLUPXLVDGM-UHFFFAOYSA-N
MW216.32 g/mol
LogP4.29
Rot. Bonds3

About 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene

1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene (PubChem CID 175668823) has the molecular formula C15H20O and a molecular weight of 216.32 g/mol. Its IUPAC name is 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene.

Molecular Properties

Compound Name1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene
PubChem CID175668823
Molecular FormulaC15H20O
Molecular Weight216.32 g/mol
Exact Mass216.15
IUPAC Name1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene
SMILESCCOc1ccccc1C1=CCC(C)CC1
InChIInChI=1S/C15H20O/c1-3-16-15-7-5-4-6-14(15)13-10-8-12(2)9-11-13/h4-7,10,12H,3,8-9,11H2,1-2H3
InChIKeyLXXBVLUPXLVDGM-UHFFFAOYSA-N
XLogP4.29
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 54.29
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-butoxy-4-(4-methylcyclohexen-1-yl)benzene
CID 4306080
1-ethoxy-2-[4-(4-phenylphenyl)phenyl]benzene
CID 151505413
1-ethoxy-4-(4-ethylcyclohexen-1-yl)-2,3-difluorobenzene
CID 168776499
2-[4-(2-ethoxyphenyl)-3,6-dihydro-2H-pyridin-1-yl]pyridine
CID 133277066
N'-[(4S)-4-methylcyclohexen-1-yl]-2-(2-phenylphenoxy)acetohydrazide
CID 2378280
[6-ethoxy-2-fluoro-3-[4-(4-methylcyclohexyl)cyclohexen-1-yl]phenyl]phosphane
CID 166903499
1-[[4-(2,3-difluoro-4-methoxyphenyl)cyclohex-3-en-1-yl]methoxy]-4-(4-ethoxy-2,3-difluorophenyl)-2,3-difluorobenzene
CID 88967649
4-(2-ethoxyphenyl)pyridine
CID 23466193
4-(2-ethoxyphenyl)phenol
CID 83129672
1-(4-ethylcyclohexen-1-yl)-4-[4-(4-methylcyclohexen-1-yl)phenyl]benzene
CID 20538245
N-[[2-(2-ethoxyphenyl)phenyl]methyl]cyclopropanamine
CID 62801536
3-chloro-1-ethoxy-4-(4-ethylcyclohexen-1-yl)-2-fluorobenzene
CID 59257307

Frequently Asked Questions

What is the IUPAC name of 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene?
The IUPAC name of 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene (CID 175668823) is 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene.
What is the SMILES notation for 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene?
The canonical SMILES for 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene is CCOc1ccccc1C1=CCC(C)CC1.
What is the InChIKey of 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene?
The InChIKey is LXXBVLUPXLVDGM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20O/c1-3-16-15-7-5-4-6-14(15)13-10-8-12(2)9-11-13/h4-7,10,12H,3,8-9,11H2,1-2H3.
What are the key properties of 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene?
1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene has a molecular weight of 216.32 g/mol, XLogP of 4.29, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethoxy-2-(4-methylcyclohexen-1-yl)benzene is sourced from PubChem (CID 175668823), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).