N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride

C20H25ClN2O — CID 27792

IUPACN-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride
SMILESCC(CN(C)C)/C(=N\C(=O)Cc1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H24N2O.ClH/c1-16(15-22(2)3)20(18-12-8-5-9-13-18)21-19(23)14-17-10-6-4-7-11-17;/h4-13,16H,14-15H2,1-3H3;1H/b21-20+;
InChIKeyOKTHJEGGKWMTAG-ANVLNOONSA-N
MW344.89 g/mol
LogP3.86
Rot. Bonds6

About N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride

N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride (PubChem CID 27792) has the molecular formula C20H25ClN2O and a molecular weight of 344.89 g/mol. Its IUPAC name is N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride.

Molecular Properties

Compound NameN-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride
PubChem CID27792
Molecular FormulaC20H25ClN2O
Molecular Weight344.89 g/mol
Exact Mass344.17
IUPAC NameN-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride
SMILESCC(CN(C)C)/C(=N\C(=O)Cc1ccccc1)c1ccccc1.Cl
InChIInChI=1S/C20H24N2O.ClH/c1-16(15-22(2)3)20(18-12-8-5-9-13-18)21-19(23)14-17-10-6-4-7-11-17;/h4-13,16H,14-15H2,1-3H3;1H/b21-20+;
InChIKeyOKTHJEGGKWMTAG-ANVLNOONSA-N
XLogP3.86
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.89
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

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Related Compounds

Diphenamid
CID 13728
N,N-diethyl-2,2-diphenylacetamide
CID 229107
CID 44294720
CID 44294720
N-(3-Dimethylamino-propyl)-N-methyl-2,2-diphenyl-acetamide
CID 10852468
2-phenyl-1-(3-phenyl-4,5-dihydro-1H-pyrazol-1-yl)ethanone
CID 686393
Acetamide, N-(alpha-(1-methyl-1-piperidinoethyl)benzylidene)-2-phenyl-, hydrochloride
CID 25985
N-(6-(Dimethylamino)-4,4-diphenyl-3-heptylidene)acetamide hydrochloride
CID 44779
Acetamide, N-(6-(dimethylamino)-4,4-diphenyl-5-methyl-3-hexylidene)-, hydrochloride
CID 44813
N-(alpha-(1-Methyl-1-piperidino-1-ethyl)benzylidene)propionamide monohydrochloride
CID 204434
N-(alpha-(1-Methyl-1-piperidinoethyl)benzilidene)benzamide monohydrochloride
CID 204436
Benzenepentanamide, N,N-diethyl-alpha-phenyl-
CID 215145
N-(6-(Dimethylamino)-4,4-diphenyl-3-heptylidene)propionamide hydrochloride
CID 3051479

Frequently Asked Questions

What is the IUPAC name of N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride?
The IUPAC name of N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride (CID 27792) is N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride.
What is the SMILES notation for N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride?
The canonical SMILES for N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride is CC(CN(C)C)/C(=N\C(=O)Cc1ccccc1)c1ccccc1.Cl.
What is the InChIKey of N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride?
The InChIKey is OKTHJEGGKWMTAG-ANVLNOONSA-N. The full InChI is InChI=1S/C20H24N2O.ClH/c1-16(15-22(2)3)20(18-12-8-5-9-13-18)21-19(23)14-17-10-6-4-7-11-17;/h4-13,16H,14-15H2,1-3H3;1H/b21-20+;.
What are the key properties of N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride?
N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride has a molecular weight of 344.89 g/mol, XLogP of 3.86, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(dimethylamino)-2-methyl-1-phenylpropylidene]-2-phenylacetamide;hydrochloride is sourced from PubChem (CID 27792), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).