N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide

C18H23N3O — CID 163646514

IUPACN-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide
SMILESCc1ccccc1Nc1ccccc1C(=O)NCCN(C)C
InChIInChI=1S/C18H23N3O/c1-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)18(22)19-12-13-21(2)3/h4-11,20H,12-13H2,1-3H3,(H,19,22)
InChIKeyIIQWRPKYRRGQGQ-UHFFFAOYSA-N
MW297.40 g/mol
LogP3.03
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide

N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide (PubChem CID 163646514) has the molecular formula C18H23N3O and a molecular weight of 297.40 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide
PubChem CID163646514
Molecular FormulaC18H23N3O
Molecular Weight297.40 g/mol
Exact Mass297.18
IUPAC NameN-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide
SMILESCc1ccccc1Nc1ccccc1C(=O)NCCN(C)C
InChIInChI=1S/C18H23N3O/c1-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)18(22)19-12-13-21(2)3/h4-11,20H,12-13H2,1-3H3,(H,19,22)
InChIKeyIIQWRPKYRRGQGQ-UHFFFAOYSA-N
XLogP3.03
TPSA44.37 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.40
LogP ≤ 53.03
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

N,N-dimethyl-2-(2-methylanilino)benzamide
CID 11402568
N-benzyl-2-(2-methylanilino)benzamide
CID 23737672
N-[2-(dimethylamino)ethyl]-2-(2-methylpropanoylamino)benzamide;hydrochloride
CID 45370530
2-[2-[2-(dimethylamino)ethylcarbamoyl]phenyl]acetic acid
CID 114199769
N-[(dimethylamino)methyl]-2-methylbenzamide
CID 67624413
1-N-[2-(dimethylamino)ethyl]-4-N-[(2-methylphenyl)methyl]benzene-1,4-dicarboxamide
CID 109045710
N-[2-(dimethylamino)ethyl]-6-(2-methylanilino)-2-phenylpyrimidine-4-carboxamide
CID 112853682
N-[2-(dimethylamino)ethyl]-9-methyldibenzo-p-dioxin-1-carboxamide
CID 11638189
2-methyl-N-[2-(propylcarbamoyl)phenyl]benzamide
CID 4945880
2-[(4-bromophenyl)sulfonylamino]-N-[2-(dimethylamino)ethyl]benzamide
CID 2347642
2-(2,3-dimethylanilino)-N-[3-[ethyl(methylsulfonyl)amino]propyl]benzamide
CID 60552297
N-[2-(dimethylamino)ethyl]-2-nitrobenzamide
CID 15287848

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide (CID 163646514) is N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide is Cc1ccccc1Nc1ccccc1C(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide?
The InChIKey is IIQWRPKYRRGQGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H23N3O/c1-14-8-4-6-10-16(14)20-17-11-7-5-9-15(17)18(22)19-12-13-21(2)3/h4-11,20H,12-13H2,1-3H3,(H,19,22).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide?
N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide has a molecular weight of 297.40 g/mol, XLogP of 3.03, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-(2-methylanilino)benzamide is sourced from PubChem (CID 163646514), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).