N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide

C18H21NO2 — CID 123310577

IUPACN-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide
SMILESCCN(Cc1ccccc1OC)C(=O)c1ccc(C)cc1
InChIInChI=1S/C18H21NO2/c1-4-19(13-16-7-5-6-8-17(16)21-3)18(20)15-11-9-14(2)10-12-15/h5-12H,4,13H2,1-3H3
InChIKeyDUDCKGMSMOVSBK-UHFFFAOYSA-N
MW283.37 g/mol
LogP3.67
Rot. Bonds5

About N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide

N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide (PubChem CID 123310577) has the molecular formula C18H21NO2 and a molecular weight of 283.37 g/mol. Its IUPAC name is N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide.

Molecular Properties

Compound NameN-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide
PubChem CID123310577
Molecular FormulaC18H21NO2
Molecular Weight283.37 g/mol
Exact Mass283.16
IUPAC NameN-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide
SMILESCCN(Cc1ccccc1OC)C(=O)c1ccc(C)cc1
InChIInChI=1S/C18H21NO2/c1-4-19(13-16-7-5-6-8-17(16)21-3)18(20)15-11-9-14(2)10-12-15/h5-12H,4,13H2,1-3H3
InChIKeyDUDCKGMSMOVSBK-UHFFFAOYSA-N
XLogP3.67
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.37
LogP ≤ 53.67
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1,1-diethyl-3-[(2-methoxyphenyl)methyl]-3-methylurea
CID 113233571
N-[2-(2-methoxyphenyl)ethyl]-4-methylbenzamide
CID 8911194
N-[(2-ethoxyphenyl)methyl]-N-ethyl-4-methylsulfonylbenzamide
CID 46987200
N-ethyl-5-fluoro-2-methoxy-N-[(2-methylphenyl)methyl]benzamide
CID 112817404
N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]-6-methylpyridine-3-carboxamide
CID 110907491
N-[(2-methoxyphenyl)methyl]-4-methyl-N-[4-[2-[methyl(propyl)amino]-2-oxoethyl]phenyl]benzamide
CID 46046689
N-benzyl-N-ethyl-6-[2-(2-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109157599
N,N-diethyl-4-[[[ethylamino-[(2-methoxyphenyl)methylamino]methylidene]amino]methyl]benzamide
CID 111215809
ethyl N-(2-hydroxyethyl)-N-[(2-methoxyphenyl)methyl]carbamate
CID 64593009
4-(aminomethyl)-N-ethyl-N-[(2-methylphenyl)methyl]benzamide
CID 43587256
N-ethyl-4-methyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 943147
N-benzyl-3-bromo-N-ethyl-4-methoxybenzamide
CID 60660630

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide?
The IUPAC name of N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide (CID 123310577) is N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide.
What is the SMILES notation for N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide?
The canonical SMILES for N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide is CCN(Cc1ccccc1OC)C(=O)c1ccc(C)cc1.
What is the InChIKey of N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide?
The InChIKey is DUDCKGMSMOVSBK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO2/c1-4-19(13-16-7-5-6-8-17(16)21-3)18(20)15-11-9-14(2)10-12-15/h5-12H,4,13H2,1-3H3.
What are the key properties of N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide?
N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide has a molecular weight of 283.37 g/mol, XLogP of 3.67, 5 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-[(2-methoxyphenyl)methyl]-4-methylbenzamide is sourced from PubChem (CID 123310577), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).