(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol

C22H28O2 — CID 102588924

IUPAC(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol
SMILESCCC/C(=C(\CCC)C(O)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C22H28O2/c1-4-9-20(17-13-15-19(24-3)16-14-17)21(10-5-2)22(23)18-11-7-6-8-12-18/h6-8,11-16,22-23H,4-5,9-10H2,1-3H3/b21-20-
InChIKeyAZXHWKMJTBIONZ-MRCUWXFGSA-N
MW324.46 g/mol
LogP5.78
Rot. Bonds8

About (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol

(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol (PubChem CID 102588924) has the molecular formula C22H28O2 and a molecular weight of 324.46 g/mol. Its IUPAC name is (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol.

Molecular Properties

Compound Name(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol
PubChem CID102588924
Molecular FormulaC22H28O2
Molecular Weight324.46 g/mol
Exact Mass324.21
IUPAC Name(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol
SMILESCCC/C(=C(\CCC)C(O)c1ccccc1)c1ccc(OC)cc1
InChIInChI=1S/C22H28O2/c1-4-9-20(17-13-15-19(24-3)16-14-17)21(10-5-2)22(23)18-11-7-6-8-12-18/h6-8,11-16,22-23H,4-5,9-10H2,1-3H3/b21-20-
InChIKeyAZXHWKMJTBIONZ-MRCUWXFGSA-N
XLogP5.78
TPSA29.46 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds8
Heavy Atoms24
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500324.46
LogP ≤ 55.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6,6-difluoro-5-(4-methoxyphenyl)-2-phenylhex-5-en-3-ol
CID 162419488
1-(4-methoxyphenyl)butan-1-one;hydrochloride
CID 162084347
1-[(Z)-1,2-diphenylbut-1-enyl]-4-methoxybenzene;ethane
CID 170597875
2-ethoxy-1-(4-methoxyphenyl)-2-phenylethanol
CID 116757104
(1R,2S)-1-(4-methoxyphenoxy)-1-phenylpropan-2-ol
CID 135066400
(1R)-1-hydroxy-1-(4-methoxyphenyl)-4-phenylbutan-2-one
CID 135044338
1-bromo-4-[4,4-difluoro-3-(4-methoxyphenyl)-1-phenylbut-3-enyl]benzene
CID 168720186
[4-(4-methoxyphenyl)phenyl]-phenylmethanol
CID 141264274
1-[bis[4-[(4-methoxyphenyl)-phenylmethyl]phenyl]methyl]-4-methoxybenzene
CID 70877905
(2R)-2-hydroxy-2-(4-methoxyphenyl)acetic acid
CID 6951708
4,5-bis(4-methoxyphenyl)-2-methylidene-5-oxo-3-phenylpentanoic acid
CID 101477479
6,6-bis(4-methoxyphenyl)-5-phenylhex-5-enenitrile
CID 101266071

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol?
The IUPAC name of (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol (CID 102588924) is (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol.
What is the SMILES notation for (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol?
The canonical SMILES for (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol is CCC/C(=C(\CCC)C(O)c1ccccc1)c1ccc(OC)cc1.
What is the InChIKey of (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol?
The InChIKey is AZXHWKMJTBIONZ-MRCUWXFGSA-N. The full InChI is InChI=1S/C22H28O2/c1-4-9-20(17-13-15-19(24-3)16-14-17)21(10-5-2)22(23)18-11-7-6-8-12-18/h6-8,11-16,22-23H,4-5,9-10H2,1-3H3/b21-20-.
What are the key properties of (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol?
(Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol has a molecular weight of 324.46 g/mol, XLogP of 5.78, 8 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(4-methoxyphenyl)-1-phenyl-2-propylhex-2-en-1-ol is sourced from PubChem (CID 102588924), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).