4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol

C18H20O2 — CID 175123260

IUPAC4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol
SMILESCOc1ccc(O)c(C(C)C(C)=Cc2ccccc2)c1
InChIInChI=1S/C18H20O2/c1-13(11-15-7-5-4-6-8-15)14(2)17-12-16(20-3)9-10-18(17)19/h4-12,14,19H,1-3H3
InChIKeyOXKPEIWXHFKNJP-UHFFFAOYSA-N
MW268.36 g/mol
LogP4.61
Rot. Bonds4

About 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol

4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol (PubChem CID 175123260) has the molecular formula C18H20O2 and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol.

Molecular Properties

Compound Name4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol
PubChem CID175123260
Molecular FormulaC18H20O2
Molecular Weight268.36 g/mol
Exact Mass268.15
IUPAC Name4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol
SMILESCOc1ccc(O)c(C(C)C(C)=Cc2ccccc2)c1
InChIInChI=1S/C18H20O2/c1-13(11-15-7-5-4-6-8-15)14(2)17-12-16(20-3)9-10-18(17)19/h4-12,14,19H,1-3H3
InChIKeyOXKPEIWXHFKNJP-UHFFFAOYSA-N
XLogP4.61
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 54.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(2-hydroxy-5-methoxyphenyl)methanediol
CID 69473075
2-[1-(hydroxyamino)ethyl]-4-methoxyphenol
CID 82685754
2-(2-hydroxy-5-methoxyphenyl)-2-phenylacetaldehyde
CID 159871714
2-[(1R,2S)-2-amino-1-hydroxypropyl]-4-methoxyphenol
CID 130898802
2-[(1S,2S)-1-amino-2-hydroxypropyl]-4-methoxyphenol
CID 130691846
1-chloro-1-(2-hydroxy-5-methoxyphenyl)propan-2-one
CID 131010117
2-[(1S,2R)-1-amino-2-hydroxypropyl]-4-methoxyphenol;hydrochloride
CID 171267529
2-[(1R)-1-amino-2,2-difluoroethyl]-4-methoxyphenol
CID 130612678
4-methoxy-2-[(Z)-3-phenylprop-2-enyl]phenol
CID 10263673
2-[(1S)-1-amino-2-fluoroethyl]-4-methoxyphenol
CID 130739611
2-(1-aminopropyl)-4-methoxyphenol
CID 19748508
2-(1,2-diaminoethyl)-4-methoxyphenol
CID 55282717

Frequently Asked Questions

What is the IUPAC name of 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol?
The IUPAC name of 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol (CID 175123260) is 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol.
What is the SMILES notation for 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol?
The canonical SMILES for 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol is COc1ccc(O)c(C(C)C(C)=Cc2ccccc2)c1.
What is the InChIKey of 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol?
The InChIKey is OXKPEIWXHFKNJP-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20O2/c1-13(11-15-7-5-4-6-8-15)14(2)17-12-16(20-3)9-10-18(17)19/h4-12,14,19H,1-3H3.
What are the key properties of 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol?
4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol has a molecular weight of 268.36 g/mol, XLogP of 4.61, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-2-(3-methyl-4-phenylbut-3-en-2-yl)phenol is sourced from PubChem (CID 175123260), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).