1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene

C14H20O — CID 20609364

IUPAC1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene
SMILESCC(C)=Cc1ccc(OCC(C)C)cc1
InChIInChI=1S/C14H20O/c1-11(2)9-13-5-7-14(8-6-13)15-10-12(3)4/h5-9,12H,10H2,1-4H3
InChIKeyOJMQENJJLLUWNZ-UHFFFAOYSA-N
MW204.31 g/mol
LogP4.14
Rot. Bonds4

About 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene

1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene (PubChem CID 20609364) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene.

Molecular Properties

Compound Name1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene
PubChem CID20609364
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene
SMILESCC(C)=Cc1ccc(OCC(C)C)cc1
InChIInChI=1S/C14H20O/c1-11(2)9-13-5-7-14(8-6-13)15-10-12(3)4/h5-9,12H,10H2,1-4H3
InChIKeyOJMQENJJLLUWNZ-UHFFFAOYSA-N
XLogP4.14
TPSA9.23 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 54.14
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

ethane;4-(2-methylpropoxy)benzaldehyde
CID 143325995
1-(2-methylprop-1-enyl)-4-(2-methylpropoxymethyl)benzene
CID 177259855
(Z)-2-(4-hydroxyphenyl)-3-[4-(2-methylpropoxy)phenyl]prop-2-enoic acid
CID 83953773
1-(2-chloroethoxy)-4-(2-methylprop-1-enyl)benzene
CID 151179000
1-[4-(2-methylpropoxy)phenyl]ethanone
CID 2063678
3-[4-(2-methylpropoxy)phenyl]prop-2-en-1-amine
CID 169464663
1-(3-bromoprop-1-enyl)-4-(2-methylpropoxy)benzene
CID 169476628
1-(2-methylprop-1-enyl)-4-tetradecoxybenzene
CID 150699958
3-[4-(2-methylpropoxy)phenyl]prop-2-enamide
CID 131842632
3-[4-(2-methylpropoxy)phenyl]prop-2-enoate
CID 4201747
diethyl 2-[[4-(2-methylpropoxy)phenyl]methylidene]butanedioate
CID 176898205
3-[4-(2-methylpropoxy)phenyl]prop-2-enenitrile
CID 169484500

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene?
The IUPAC name of 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene (CID 20609364) is 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene.
What is the SMILES notation for 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene?
The canonical SMILES for 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene is CC(C)=Cc1ccc(OCC(C)C)cc1.
What is the InChIKey of 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene?
The InChIKey is OJMQENJJLLUWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-11(2)9-13-5-7-14(8-6-13)15-10-12(3)4/h5-9,12H,10H2,1-4H3.
What are the key properties of 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene?
1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene has a molecular weight of 204.31 g/mol, XLogP of 4.14, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylprop-1-enyl)-4-(2-methylpropoxy)benzene is sourced from PubChem (CID 20609364), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).