5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride

C19H24ClNO — CID 171145453

IUPAC5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride
SMILESCN(C)CC=CCC(O)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C19H23NO.ClH/c1-20(2)16-10-9-15-19(21,17-11-5-3-6-12-17)18-13-7-4-8-14-18;/h3-14,21H,15-16H2,1-2H3;1H
InChIKeyNDTLGWOLQPADOC-UHFFFAOYSA-N
MW317.86 g/mol
LogP3.85
Rot. Bonds6

About 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride

5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride (PubChem CID 171145453) has the molecular formula C19H24ClNO and a molecular weight of 317.86 g/mol. Its IUPAC name is 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride.

Molecular Properties

Compound Name5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride
PubChem CID171145453
Molecular FormulaC19H24ClNO
Molecular Weight317.86 g/mol
Exact Mass317.15
IUPAC Name5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride
SMILESCN(C)CC=CCC(O)(c1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C19H23NO.ClH/c1-20(2)16-10-9-15-19(21,17-11-5-3-6-12-17)18-13-7-4-8-14-18;/h3-14,21H,15-16H2,1-2H3;1H
InChIKeyNDTLGWOLQPADOC-UHFFFAOYSA-N
XLogP3.85
TPSA23.47 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500317.86
LogP ≤ 53.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

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propan-2-yl (E)-6-hydroxy-6,6-diphenylhex-3-enedithioate
CID 5369781
2-(N-methylanilino)-1,1-diphenylethanol
CID 138972494
(1R)-1-(2-chlorophenyl)-3-(dimethylamino)-1-phenylpropan-1-ol;hydrochloride
CID 73415977
(E)-2,2-diphenylhept-4-en-1-ol
CID 177416066
(Z)-3-diphenylphosphanyl-N,N-dimethylprop-2-en-1-amine
CID 14909100
3-[methyl-[2-(methylamino)ethyl]amino]-1,1-diphenylpropan-1-ol;dihydrochloride
CID 70578560
2-iodo-1,1-diphenylethanol
CID 11738821
(E)-N,N-dimethyl-3-phenyl-3-[3-(trifluoromethyl)phenyl]prop-2-en-1-amine;hydrochloride
CID 6437916
(E)-4-(dimethylamino)-N-(3-hydroxy-2-methyl-2-phenylpropyl)but-2-enamide
CID 146097720
1-[4-(dimethylamino)phenyl]-3,3,4,4,5,5,6,6,7,7,8,8,8-tridecafluoro-1-phenyloctan-1-ol
CID 162348335
2-[[(1S,2S)-2-[(2-hydroxy-2,2-diphenylethyl)-methylamino]cyclohexyl]-methylamino]-1,1-diphenylethanol
CID 101490678

Frequently Asked Questions

What is the IUPAC name of 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride?
The IUPAC name of 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride (CID 171145453) is 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride.
What is the SMILES notation for 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride?
The canonical SMILES for 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride is CN(C)CC=CCC(O)(c1ccccc1)c1ccccc1.Cl.
What is the InChIKey of 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride?
The InChIKey is NDTLGWOLQPADOC-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23NO.ClH/c1-20(2)16-10-9-15-19(21,17-11-5-3-6-12-17)18-13-7-4-8-14-18;/h3-14,21H,15-16H2,1-2H3;1H.
What are the key properties of 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride?
5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride has a molecular weight of 317.86 g/mol, XLogP of 3.85, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(dimethylamino)-1,1-diphenylpent-3-en-1-ol;hydrochloride is sourced from PubChem (CID 171145453), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).