4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide

C20H26N2O2 — CID 46435285

IUPAC4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCCN(CC)Cc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C20H26N2O2/c1-5-22(6-2)14-16-8-10-17(11-9-16)20(23)21-18-13-15(3)7-12-19(18)24-4/h7-13H,5-6,14H2,1-4H3,(H,21,23)
InChIKeyLXFWDKJBZVLSDP-UHFFFAOYSA-N
MW326.44 g/mol
LogP4.10
Rot. Bonds7

About 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide

4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide (PubChem CID 46435285) has the molecular formula C20H26N2O2 and a molecular weight of 326.44 g/mol. Its IUPAC name is 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide.

Molecular Properties

Compound Name4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide
PubChem CID46435285
Molecular FormulaC20H26N2O2
Molecular Weight326.44 g/mol
Exact Mass326.20
IUPAC Name4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide
SMILESCCN(CC)Cc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1
InChIInChI=1S/C20H26N2O2/c1-5-22(6-2)14-16-8-10-17(11-9-16)20(23)21-18-13-15(3)7-12-19(18)24-4/h7-13H,5-6,14H2,1-4H3,(H,21,23)
InChIKeyLXFWDKJBZVLSDP-UHFFFAOYSA-N
XLogP4.10
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500326.44
LogP ≤ 54.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(cyanomethyl)-N-(2-methoxy-5-methylphenyl)benzamide
CID 82179481
4-methoxy-N-(2-methoxy-5-methylphenyl)benzamide
CID 2302629
4-(ethylamino)-N-(2-methoxy-5-methylphenyl)benzamide
CID 62171726
4-formyl-N-(2-methoxy-5-methylphenyl)benzamide
CID 134025426
N-(2-methoxy-5-methylphenyl)-4-(propanoylamino)benzamide
CID 2985570
4-(diethylaminomethyl)-N-[4-(2-methoxy-5-methylphenyl)-1,3-thiazol-2-yl]benzamide
CID 43070034
1-N-(2-methoxyethyl)-4-N-(2-methoxy-5-methylphenyl)benzene-1,4-dicarboxamide
CID 109045188
1-N-benzyl-4-N-(2-methoxy-5-methylphenyl)benzene-1,4-dicarboxamide
CID 109046739
N-(2-methoxy-5-methylphenyl)-4-(phenylsulfanylmethyl)benzamide
CID 28771995
N-(2-methoxy-5-methylphenyl)-4-(pyrrolidin-1-ylsulfonylmethyl)benzamide
CID 46763715
3-(diethylsulfamoyl)-N-(2-methoxy-5-methylphenyl)-4-methylbenzamide
CID 26414114
3-(ethoxymethyl)-4-methoxy-N-(2-methoxy-5-methylphenyl)benzamide
CID 24502664

Frequently Asked Questions

What is the IUPAC name of 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide?
The IUPAC name of 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide (CID 46435285) is 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide.
What is the SMILES notation for 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide?
The canonical SMILES for 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide is CCN(CC)Cc1ccc(C(=O)Nc2cc(C)ccc2OC)cc1.
What is the InChIKey of 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide?
The InChIKey is LXFWDKJBZVLSDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H26N2O2/c1-5-22(6-2)14-16-8-10-17(11-9-16)20(23)21-18-13-15(3)7-12-19(18)24-4/h7-13H,5-6,14H2,1-4H3,(H,21,23).
What are the key properties of 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide?
4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide has a molecular weight of 326.44 g/mol, XLogP of 4.10, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(diethylaminomethyl)-N-(2-methoxy-5-methylphenyl)benzamide is sourced from PubChem (CID 46435285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).