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

C21H26FNO — CID 69339308

IUPAC(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
SMILESC/C(=C/c1ccccc1)C(O)(c1ccc(F)cc1)C(C)CN(C)C
InChIInChI=1S/C21H26FNO/c1-16(14-18-8-6-5-7-9-18)21(24,17(2)15-23(3)4)19-10-12-20(22)13-11-19/h5-14,17,24H,15H2,1-4H3/b16-14-
InChIKeyBMKNZZQRQWHOND-PEZBUJJGSA-N
MW327.44 g/mol
LogP4.31
Rot. Bonds6

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

(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol (PubChem CID 69339308) has the molecular formula C21H26FNO and a molecular weight of 327.44 g/mol. Its IUPAC name is (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol.

Molecular Properties

Compound Name(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
PubChem CID69339308
Molecular FormulaC21H26FNO
Molecular Weight327.44 g/mol
Exact Mass327.20
IUPAC Name(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
SMILESC/C(=C/c1ccccc1)C(O)(c1ccc(F)cc1)C(C)CN(C)C
InChIInChI=1S/C21H26FNO/c1-16(14-18-8-6-5-7-9-18)21(24,17(2)15-23(3)4)19-10-12-20(22)13-11-19/h5-14,17,24H,15H2,1-4H3/b16-14-
InChIKeyBMKNZZQRQWHOND-PEZBUJJGSA-N
XLogP4.31
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.44
LogP ≤ 54.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(E)-5-(dimethylamino)-3-(3-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 10131431
3-(4-chlorophenyl)-5-(dimethylamino)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69338828
(E)-5-(dimethylamino)-1-(4-fluorophenyl)-3-(4-methoxyphenyl)-2,4-dimethylpent-1-en-3-ol
CID 22643099
(Z)-5-(dimethylamino)-3-(4-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69338687
(E)-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethyl-3-(3-methylphenyl)pent-1-en-3-ol
CID 22642886
3-(3,5-dichlorophenyl)-5-(dimethylamino)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69339203
3-[4-chloro-3-(trifluoromethyl)phenyl]-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethylpent-1-en-3-ol
CID 69338936
5-(dimethylamino)-3-(2-methoxyphenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol
CID 69339291
(Z)-3-(2,3-dichlorophenyl)-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethylpent-1-en-3-ol
CID 69339559
(E)-3-cyclopentyl-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethylpent-1-en-3-ol
CID 69338484
3-[1-(dimethylamino)propan-2-yl]-2-methyl-1,6-diphenylhex-1-en-3-ol
CID 69338574
(Z)-3-[(4-chlorophenyl)methyl]-5-(dimethylamino)-1-(4-fluorophenyl)-2,4-dimethylpent-1-en-3-ol
CID 69338748

Frequently Asked Questions

What is the IUPAC name of (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The IUPAC name of (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol (CID 69339308) is (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol.
What is the SMILES notation for (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The canonical SMILES for (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol is C/C(=C/c1ccccc1)C(O)(c1ccc(F)cc1)C(C)CN(C)C.
What is the InChIKey of (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
The InChIKey is BMKNZZQRQWHOND-PEZBUJJGSA-N. The full InChI is InChI=1S/C21H26FNO/c1-16(14-18-8-6-5-7-9-18)21(24,17(2)15-23(3)4)19-10-12-20(22)13-11-19/h5-14,17,24H,15H2,1-4H3/b16-14-.
What are the key properties of (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol?
(Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol has a molecular weight of 327.44 g/mol, XLogP of 4.31, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-5-(dimethylamino)-3-(4-fluorophenyl)-2,4-dimethyl-1-phenylpent-1-en-3-ol is sourced from PubChem (CID 69339308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).