(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol

C22H29NO2 — CID 69338687

IUPAC(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
SMILESCOc1ccc(C(O)(/C(C)=C\c2ccccc2)C(C)CN(C)C)cc1
InChIInChI=1S/C22H29NO2/c1-17(15-19-9-7-6-8-10-19)22(24,18(2)16-23(3)4)20-11-13-21(25-5)14-12-20/h6-15,18,24H,16H2,1-5H3/b17-15-
InChIKeyNGDDEVCJYCBPPM-ICFOKQHNSA-N
MW339.48 g/mol
LogP4.18
Rot. Bonds7

About (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol

(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol (PubChem CID 69338687) has the molecular formula C22H29NO2 and a molecular weight of 339.48 g/mol. Its IUPAC name is (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol.

Molecular Properties

Compound Name(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
PubChem CID69338687
Molecular FormulaC22H29NO2
Molecular Weight339.48 g/mol
Exact Mass339.22
IUPAC Name(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
SMILESCOc1ccc(C(O)(/C(C)=C\c2ccccc2)C(C)CN(C)C)cc1
InChIInChI=1S/C22H29NO2/c1-17(15-19-9-7-6-8-10-19)22(24,18(2)16-23(3)4)20-11-13-21(25-5)14-12-20/h6-15,18,24H,16H2,1-5H3/b17-15-
InChIKeyNGDDEVCJYCBPPM-ICFOKQHNSA-N
XLogP4.18
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.48
LogP ≤ 54.18
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

(E)-5-(dimethylamino)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)-2,4-dimethylpent-1-en-3-ol
CID 22643099
3-(4-chlorophenyl)-5-(dimethylamino)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69338828
(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69339308
5-(dimethylamino)-3-(2-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69339291
3-(3,5-dichlorophenyl)-5-(dimethylamino)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69339203
(E)-5-(dimethylamino)-3-(3-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 10131431
(E)-5-(dimethylamino)-1-(4-methoxyphenyl)-2,4-dimethyl-3-(2-phenylethyl)pent-1-en-3-ol
CID 22643026
(E)-5-(dimethylamino)-3-[(3-fluorophenyl)methyl]-1-(4-methoxyphenyl)-2,4-dimethylpent-1-en-3-ol
CID 22642700
(E)-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethyl-3-(3-methylphenyl)pent-1-en-3-ol
CID 22642886
3-[1-(dimethylamino)propan-2-yl]-2-methyl-1,6-diphenylhex-1-en-3-ol
CID 69338574
3-[6-(dimethylamino)-3-hydroxy-2,4-dimethyl-1-phenylhex-1-en-3-yl]phenol
CID 69339880
(Z)-3-[(3-chlorophenyl)methyl]-5-(dimethylamino)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69338670

Frequently Asked Questions

What is the IUPAC name of (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The IUPAC name of (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol (CID 69338687) is (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol.
What is the SMILES notation for (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The canonical SMILES for (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol is COc1ccc(C(O)(/C(C)=C\c2ccccc2)C(C)CN(C)C)cc1.
What is the InChIKey of (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The InChIKey is NGDDEVCJYCBPPM-ICFOKQHNSA-N. The full InChI is InChI=1S/C22H29NO2/c1-17(15-19-9-7-6-8-10-19)22(24,18(2)16-23(3)4)20-11-13-21(25-5)14-12-20/h6-15,18,24H,16H2,1-5H3/b17-15-.
What are the key properties of (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol has a molecular weight of 339.48 g/mol, XLogP of 4.18, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol is sourced from PubChem (CID 69338687), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).