3-(dimethylamino)-N-(4-methylphenyl)benzamide

C16H18N2O — CID 7899886

IUPAC3-(dimethylamino)-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1
InChIInChI=1S/C16H18N2O/c1-12-7-9-14(10-8-12)17-16(19)13-5-4-6-15(11-13)18(2)3/h4-11H,1-3H3,(H,17,19)
InChIKeyBDKCEAJYSHPNKC-UHFFFAOYSA-N
MW254.33 g/mol
LogP3.31
Rot. Bonds3

About 3-(dimethylamino)-N-(4-methylphenyl)benzamide

3-(dimethylamino)-N-(4-methylphenyl)benzamide (PubChem CID 7899886) has the molecular formula C16H18N2O and a molecular weight of 254.33 g/mol. Its IUPAC name is 3-(dimethylamino)-N-(4-methylphenyl)benzamide.

Molecular Properties

Compound Name3-(dimethylamino)-N-(4-methylphenyl)benzamide
PubChem CID7899886
Molecular FormulaC16H18N2O
Molecular Weight254.33 g/mol
Exact Mass254.14
IUPAC Name3-(dimethylamino)-N-(4-methylphenyl)benzamide
SMILESCc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1
InChIInChI=1S/C16H18N2O/c1-12-7-9-14(10-8-12)17-16(19)13-5-4-6-15(11-13)18(2)3/h4-11H,1-3H3,(H,17,19)
InChIKeyBDKCEAJYSHPNKC-UHFFFAOYSA-N
XLogP3.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500254.33
LogP ≤ 53.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-(4-bromophenyl)-3-(dimethylamino)benzamide
CID 690521
3-(dimethylamino)-N-(4-formylphenyl)benzamide
CID 106912114
N-[4-(diethylamino)phenyl]-3-(dimethylamino)benzamide
CID 8761945
N-(4-carbamothioylphenyl)-3-(dimethylamino)benzamide
CID 43329185
N-(3-acetylphenyl)-3-(dimethylamino)benzamide
CID 7922589
3-(dimethylamino)-N-(2,4-dimethylphenyl)benzamide
CID 2081678
3-(dimethylamino)-N-[4-(2-methoxyethoxy)phenyl]benzamide
CID 46437083
3-(dimethylamino)-N-(4-methoxy-3-methylphenyl)benzamide
CID 87032363
3-hydroxy-N-(4-methylphenyl)benzamide
CID 10900357
N-(3-chlorophenyl)-3-(dimethylamino)benzamide
CID 690525
3-(dimethylamino)-N-(2-fluoro-4-methylphenyl)benzamide
CID 26522946
N-[3-[[3-(dimethylamino)benzoyl]amino]phenyl]pyridine-4-carboxamide
CID 55610611

Frequently Asked Questions

What is the IUPAC name of 3-(dimethylamino)-N-(4-methylphenyl)benzamide?
The IUPAC name of 3-(dimethylamino)-N-(4-methylphenyl)benzamide (CID 7899886) is 3-(dimethylamino)-N-(4-methylphenyl)benzamide.
What is the SMILES notation for 3-(dimethylamino)-N-(4-methylphenyl)benzamide?
The canonical SMILES for 3-(dimethylamino)-N-(4-methylphenyl)benzamide is Cc1ccc(NC(=O)c2cccc(N(C)C)c2)cc1.
What is the InChIKey of 3-(dimethylamino)-N-(4-methylphenyl)benzamide?
The InChIKey is BDKCEAJYSHPNKC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18N2O/c1-12-7-9-14(10-8-12)17-16(19)13-5-4-6-15(11-13)18(2)3/h4-11H,1-3H3,(H,17,19).
What are the key properties of 3-(dimethylamino)-N-(4-methylphenyl)benzamide?
3-(dimethylamino)-N-(4-methylphenyl)benzamide has a molecular weight of 254.33 g/mol, XLogP of 3.31, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(dimethylamino)-N-(4-methylphenyl)benzamide is sourced from PubChem (CID 7899886), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).