N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide

C18H22N2O2 — CID 110408034

IUPACN-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)cc1C(=O)NCCN(C)C
InChIInChI=1S/C18H22N2O2/c1-20(2)12-11-19-18(21)16-13-15(9-10-17(16)22-3)14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3,(H,19,21)
InChIKeyLUZSSFOBWRDTSR-UHFFFAOYSA-N
MW298.39 g/mol
LogP2.65
Rot. Bonds6

About N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide

N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide (PubChem CID 110408034) has the molecular formula C18H22N2O2 and a molecular weight of 298.39 g/mol. Its IUPAC name is N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide.

Molecular Properties

Compound NameN-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide
PubChem CID110408034
Molecular FormulaC18H22N2O2
Molecular Weight298.39 g/mol
Exact Mass298.17
IUPAC NameN-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide
SMILESCOc1ccc(-c2ccccc2)cc1C(=O)NCCN(C)C
InChIInChI=1S/C18H22N2O2/c1-20(2)12-11-19-18(21)16-13-15(9-10-17(16)22-3)14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3,(H,19,21)
InChIKeyLUZSSFOBWRDTSR-UHFFFAOYSA-N
XLogP2.65
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.39
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(dimethylamino)ethyl]-2-methoxy-5-methylbenzamide
CID 110761060
N-(4-acetamidobutyl)-2-methoxy-5-phenylbenzamide
CID 110609817
N-(3-acetamidopropyl)-2-methoxy-5-phenylbenzamide
CID 110630734
2-methoxy-5-phenyl-N-(pyridin-4-ylmethyl)benzamide
CID 110410764
N-cyclopropyl-2-methoxy-5-phenylbenzamide
CID 110406431
N-[2-[acetyl-[2-(dimethylamino)ethyl]amino]ethyl]-2-methoxybenzamide
CID 113053530
2-methoxy-N-[2-(4-methylpiperazin-1-yl)-2-oxoethyl]-5-phenylbenzamide
CID 110605924
[2-(octadecylcarbamoyl)-4-phenylphenyl] hypoiodite
CID 174323115
5-amino-N-[2-[ethyl(methyl)amino]ethyl]-2-methoxybenzamide
CID 62634324
N-[2-(dimethylamino)ethyl]-2-hydroxy-5-[3-(2-methoxyphenyl)-1H-pyrrolo[2,3-b]pyridin-5-yl]benzamide
CID 44555167
2-[2-[2-(dimethylamino)ethylcarbamoyl]phenyl]acetic acid
CID 114199769
N-(2-aminoethyl)-5-fluoro-2-methoxybenzamide
CID 119385341

Frequently Asked Questions

What is the IUPAC name of N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide?
The IUPAC name of N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide (CID 110408034) is N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide.
What is the SMILES notation for N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide?
The canonical SMILES for N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide is COc1ccc(-c2ccccc2)cc1C(=O)NCCN(C)C.
What is the InChIKey of N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide?
The InChIKey is LUZSSFOBWRDTSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2/c1-20(2)12-11-19-18(21)16-13-15(9-10-17(16)22-3)14-7-5-4-6-8-14/h4-10,13H,11-12H2,1-3H3,(H,19,21).
What are the key properties of N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide?
N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide has a molecular weight of 298.39 g/mol, XLogP of 2.65, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(dimethylamino)ethyl]-2-methoxy-5-phenylbenzamide is sourced from PubChem (CID 110408034), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).