4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide

C17H20N2O — CID 110487766

IUPAC4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C17H20N2O/c1-18(2)16-11-9-14(10-12-16)13-5-7-15(8-6-13)17(20)19(3)4/h5-12H,1-4H3
InChIKeyCBJVBHSADPXFFI-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.12
Rot. Bonds3

About 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide

4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide (PubChem CID 110487766) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide.

Molecular Properties

Compound Name4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide
PubChem CID110487766
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide
SMILESCN(C)C(=O)c1ccc(-c2ccc(N(C)C)cc2)cc1
InChIInChI=1S/C17H20N2O/c1-18(2)16-11-9-14(10-12-16)13-5-7-15(8-6-13)17(20)19(3)4/h5-12H,1-4H3
InChIKeyCBJVBHSADPXFFI-UHFFFAOYSA-N
XLogP3.12
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

4-(4-hydroxyphenyl)-N,N-dimethylbenzamide
CID 53218656
4-[4-(dimethylamino)phenyl]-N-methylbenzamide
CID 110487764
N,N-dimethyl-4-(6-oxo-1H-pyridin-3-yl)benzamide
CID 53218069
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline;ethane
CID 91522137
N,N-dimethylmethanamine;4-hydroxy-N,N-dimethylbenzamide
CID 143686918
CID 69397190
CID 69397190
4-(dimethylamino)benzoic acid;hydrochloride
CID 67236590
4-[4-(furan-2-yl)phenyl]-N,N-dimethylbenzamide
CID 168525452
4-(dimethylamino)-N-hydroxy-N-phenylbenzamide
CID 71402496
4-[4-(dimethylamino)phenyl]-N,N-dimethylaniline;methylsulfinylmethane
CID 157316165
4-(dimethylamino)benzoyl fluoride;ethane
CID 90963385
N,N-dimethyl-3-(4-methylphenyl)benzamide
CID 121373381

Frequently Asked Questions

What is the IUPAC name of 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide?
The IUPAC name of 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide (CID 110487766) is 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide.
What is the SMILES notation for 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide?
The canonical SMILES for 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide is CN(C)C(=O)c1ccc(-c2ccc(N(C)C)cc2)cc1.
What is the InChIKey of 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide?
The InChIKey is CBJVBHSADPXFFI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-18(2)16-11-9-14(10-12-16)13-5-7-15(8-6-13)17(20)19(3)4/h5-12H,1-4H3.
What are the key properties of 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide?
4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide has a molecular weight of 268.36 g/mol, XLogP of 3.12, 3 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[4-(dimethylamino)phenyl]-N,N-dimethylbenzamide is sourced from PubChem (CID 110487766), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).