2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one

C19H24N2O — CID 67723970

IUPAC2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one
SMILESCN(C)c1ccc(C(=O)C(Cc2ccccc2)N(C)C)cc1
InChIInChI=1S/C19H24N2O/c1-20(2)17-12-10-16(11-13-17)19(22)18(21(3)4)14-15-8-6-5-7-9-15/h5-13,18H,14H2,1-4H3
InChIKeyGLVBQGYZXOAOGP-UHFFFAOYSA-N
MW296.41 g/mol
LogP3.11
Rot. Bonds6

About 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one

2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one (PubChem CID 67723970) has the molecular formula C19H24N2O and a molecular weight of 296.41 g/mol. Its IUPAC name is 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one.

Molecular Properties

Compound Name2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one
PubChem CID67723970
Molecular FormulaC19H24N2O
Molecular Weight296.41 g/mol
Exact Mass296.19
IUPAC Name2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one
SMILESCN(C)c1ccc(C(=O)C(Cc2ccccc2)N(C)C)cc1
InChIInChI=1S/C19H24N2O/c1-20(2)17-12-10-16(11-13-17)19(22)18(21(3)4)14-15-8-6-5-7-9-15/h5-13,18H,14H2,1-4H3
InChIKeyGLVBQGYZXOAOGP-UHFFFAOYSA-N
XLogP3.11
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.41
LogP ≤ 53.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-(dimethylamino)-1,3-diphenylpropan-1-one;hydrochloride
CID 15945335
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CID 13379507
2-(dimethylamino)-3-(4-nitrophenyl)-1-phenylpropan-1-one
CID 12727858
2-(benzylamino)-1-[4-(dimethylamino)phenyl]propan-1-one;hydrochloride
CID 172677364
methyl (2S)-2-[[4-(dimethylamino)benzoyl]amino]-3-phenylpropanoate
CID 27228197
2-[[4-(dimethylamino)phenyl]methyl]propanedioic acid
CID 15120645
6-[(2S)-2-(dimethylamino)-3-phenylpropanoyl]-4H-1,4-benzoxazin-3-one
CID 2398221
[4-(dimethylamino)phenyl]-phenylmethanone
CID 10737
(2R)-2-benzyl-3-(dimethylamino)-1-phenylpropan-1-one
CID 97356031
N-[4-(dimethylamino)phenyl]-2-phenylacetamide
CID 4095589
2-[4-(dimethylamino)phenyl]-1-phenylpropan-1-one;hydrochloride
CID 172756921

Frequently Asked Questions

What is the IUPAC name of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one?
The IUPAC name of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one (CID 67723970) is 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one.
What is the SMILES notation for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one?
The canonical SMILES for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one is CN(C)c1ccc(C(=O)C(Cc2ccccc2)N(C)C)cc1.
What is the InChIKey of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one?
The InChIKey is GLVBQGYZXOAOGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H24N2O/c1-20(2)17-12-10-16(11-13-17)19(22)18(21(3)4)14-15-8-6-5-7-9-15/h5-13,18H,14H2,1-4H3.
What are the key properties of 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one?
2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one has a molecular weight of 296.41 g/mol, XLogP of 3.11, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(dimethylamino)-1-[4-(dimethylamino)phenyl]-3-phenylpropan-1-one is sourced from PubChem (CID 67723970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).