2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene

C14H20O — CID 90838901

IUPAC2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene
SMILESCC=Cc1cccc(OC(C)C)c1CC
InChIInChI=1S/C14H20O/c1-5-8-12-9-7-10-14(13(12)6-2)15-11(3)4/h5,7-11H,6H2,1-4H3
InChIKeyLPIMNPGPCXNIRI-UHFFFAOYSA-N
MW204.31 g/mol
LogP4.07
Rot. Bonds4

About 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene

2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene (PubChem CID 90838901) has the molecular formula C14H20O and a molecular weight of 204.31 g/mol. Its IUPAC name is 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene.

Molecular Properties

Compound Name2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene
PubChem CID90838901
Molecular FormulaC14H20O
Molecular Weight204.31 g/mol
Exact Mass204.15
IUPAC Name2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene
SMILESCC=Cc1cccc(OC(C)C)c1CC
InChIInChI=1S/C14H20O/c1-5-8-12-9-7-10-14(13(12)6-2)15-11(3)4/h5,7-11H,6H2,1-4H3
InChIKeyLPIMNPGPCXNIRI-UHFFFAOYSA-N
XLogP4.07
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 ≤ 54.07
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethenyl-2-ethyl-3-prop-1-enylbenzene
CID 90726745
(2-ethyl-3-propan-2-yloxyphenyl) acetate
CID 151326278
2-(2-prop-1-enylphenoxy)propan-1-amine
CID 76943563
1-(1-bromopropan-2-yloxy)-2-prop-1-enylbenzene
CID 131866211
[4-propan-2-yloxy-3-[(Z)-prop-1-enyl]phenyl]methanol
CID 177450686
2-(hydroxymethyl)-3-[(E)-prop-1-enyl]phenol
CID 10313264
2-(3-hydroxypropyl)-3-propan-2-yloxyphenol
CID 117300578
ethane;1-prop-1-enyl-2-propoxybenzene
CID 91525443
2,6-bis[(E)-prop-1-enyl]phenol
CID 21472692
4-(2-prop-1-enylphenoxy)pentan-1-amine
CID 76943605
2-[2-[(E)-prop-1-enyl]phenoxy]pentan-1-amine
CID 83045143
2-(2-methoxy-6-propan-2-yloxyphenyl)-N-methylethanamine
CID 117320466

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene?
The IUPAC name of 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene (CID 90838901) is 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene.
What is the SMILES notation for 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene?
The canonical SMILES for 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene is CC=Cc1cccc(OC(C)C)c1CC.
What is the InChIKey of 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene?
The InChIKey is LPIMNPGPCXNIRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20O/c1-5-8-12-9-7-10-14(13(12)6-2)15-11(3)4/h5,7-11H,6H2,1-4H3.
What are the key properties of 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene?
2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene has a molecular weight of 204.31 g/mol, XLogP of 4.07, 4 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-1-propan-2-yloxy-3-prop-1-enylbenzene is sourced from PubChem (CID 90838901), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).