4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide

C17H20N2O — CID 43601035

IUPAC4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide
SMILESCCc1ccc(C(=O)Nc2ccccc2CNC)cc1
InChIInChI=1S/C17H20N2O/c1-3-13-8-10-14(11-9-13)17(20)19-16-7-5-4-6-15(16)12-18-2/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyWZSKWWBUWPNBMM-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.22
Rot. Bonds5

About 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide

4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide (PubChem CID 43601035) has the molecular formula C17H20N2O and a molecular weight of 268.36 g/mol. Its IUPAC name is 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide.

Molecular Properties

Compound Name4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide
PubChem CID43601035
Molecular FormulaC17H20N2O
Molecular Weight268.36 g/mol
Exact Mass268.16
IUPAC Name4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide
SMILESCCc1ccc(C(=O)Nc2ccccc2CNC)cc1
InChIInChI=1S/C17H20N2O/c1-3-13-8-10-14(11-9-13)17(20)19-16-7-5-4-6-15(16)12-18-2/h4-11,18H,3,12H2,1-2H3,(H,19,20)
InChIKeyWZSKWWBUWPNBMM-UHFFFAOYSA-N
XLogP3.22
TPSA41.13 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

4-(aminomethyl)-N-(2-ethylphenyl)benzamide
CID 16782121
3,4-dimethyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43601073
3,4-dichloro-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600909
3,4-diethoxy-N-[2-(methylaminomethyl)phenyl]benzamide
CID 119437877
1-N-benzyl-4-N-(2-ethylphenyl)benzene-1,4-dicarboxamide
CID 109046713
3-hydroxy-4-methyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 43600945
4-ethyl-N-[2-(2-ethylanilino)-2-oxoethyl]benzamide
CID 26678506
4-fluoro-3-methyl-N-[2-(methylaminomethyl)phenyl]benzamide
CID 63213814
5-[[2-(methylaminomethyl)phenyl]carbamoyl]pyridine-2-carboxylic acid
CID 61408290
4-acetyl-N-[2-(ethylaminomethyl)phenyl]benzamide;hydrochloride
CID 86779920
N-[2-(methylaminomethyl)phenyl]-1H-pyrrole-2-carboxamide
CID 43601088
N-[2-(methylaminomethyl)phenyl]-2-phenylacetamide
CID 43601028

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide?
The IUPAC name of 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide (CID 43601035) is 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide.
What is the SMILES notation for 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide?
The canonical SMILES for 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide is CCc1ccc(C(=O)Nc2ccccc2CNC)cc1.
What is the InChIKey of 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide?
The InChIKey is WZSKWWBUWPNBMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N2O/c1-3-13-8-10-14(11-9-13)17(20)19-16-7-5-4-6-15(16)12-18-2/h4-11,18H,3,12H2,1-2H3,(H,19,20).
What are the key properties of 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide?
4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide has a molecular weight of 268.36 g/mol, XLogP of 3.22, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-N-[2-(methylaminomethyl)phenyl]benzamide is sourced from PubChem (CID 43601035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).