ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene

C14H24O — CID 142904344

IUPACethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene
SMILESCC.CCc1ccc(OC)c(C(C)C)c1
InChIInChI=1S/C12H18O.C2H6/c1-5-10-6-7-12(13-4)11(8-10)9(2)3;1-2/h6-9H,5H2,1-4H3;1-2H3
InChIKeyMQTDNISFOZWPMG-UHFFFAOYSA-N
MW208.34 g/mol
LogP4.41
Rot. Bonds3

About ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene

ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene (PubChem CID 142904344) has the molecular formula C14H24O and a molecular weight of 208.34 g/mol. Its IUPAC name is ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene.

Molecular Properties

Compound Nameethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene
PubChem CID142904344
Molecular FormulaC14H24O
Molecular Weight208.34 g/mol
Exact Mass208.18
IUPAC Nameethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene
SMILESCC.CCc1ccc(OC)c(C(C)C)c1
InChIInChI=1S/C12H18O.C2H6/c1-5-10-6-7-12(13-4)11(8-10)9(2)3;1-2/h6-9H,5H2,1-4H3;1-2H3
InChIKeyMQTDNISFOZWPMG-UHFFFAOYSA-N
XLogP4.41
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.34
LogP ≤ 54.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

chloro-(5-ethyl-2-methoxyphenyl)methanamine
CID 116947761
1-(5-ethyl-2-methoxyphenyl)-N,N-dimethylethanamine
CID 116914618
tris(4-ethyl-2-propan-2-ylphenyl) phosphite
CID 139909258
2-(4-methoxy-3-propan-2-ylphenyl)ethanethiol
CID 82126770
2-amino-2-(5-ethyl-2-methoxyphenyl)ethanethiol
CID 116830495
1-(5-ethyl-2-methoxyphenyl)-N'-methylmethanediamine
CID 116939309
2-(bromomethyl)-4-ethyl-1-methoxybenzene
CID 116932379
1-methoxy-4-(4-methylpentyl)-2-propan-2-ylbenzene
CID 163377100
3-amino-3-(5-ethyl-2-methoxyphenyl)propane-1-thiol
CID 116831240
1-(5-ethyl-2-methoxyphenyl)-N'-methylethane-1,2-diamine
CID 116932463
4-(5-ethyl-2-methoxyphenyl)pentan-1-amine
CID 112512089
2-[(4-methoxy-3-propan-2-ylphenyl)methyl]butanenitrile
CID 116931503

Frequently Asked Questions

What is the IUPAC name of ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene?
The IUPAC name of ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene (CID 142904344) is ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene.
What is the SMILES notation for ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene?
The canonical SMILES for ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene is CC.CCc1ccc(OC)c(C(C)C)c1.
What is the InChIKey of ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene?
The InChIKey is MQTDNISFOZWPMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18O.C2H6/c1-5-10-6-7-12(13-4)11(8-10)9(2)3;1-2/h6-9H,5H2,1-4H3;1-2H3.
What are the key properties of ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene?
ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene has a molecular weight of 208.34 g/mol, XLogP of 4.41, 3 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-ethyl-1-methoxy-2-propan-2-ylbenzene is sourced from PubChem (CID 142904344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).