N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide

C17H18ClNO4 — CID 30804314

IUPACN-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(OC)c(OC)cc1Cl
InChIInChI=1S/C17H18ClNO4/c1-4-23-14-8-6-5-7-11(14)17(20)19-13-10-16(22-3)15(21-2)9-12(13)18/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyNAOKOBLXHBJWBF-UHFFFAOYSA-N
MW335.79 g/mol
LogP4.01
Rot. Bonds6

About N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide

N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide (PubChem CID 30804314) has the molecular formula C17H18ClNO4 and a molecular weight of 335.79 g/mol. Its IUPAC name is N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide.

Molecular Properties

Compound NameN-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide
PubChem CID30804314
Molecular FormulaC17H18ClNO4
Molecular Weight335.79 g/mol
Exact Mass335.09
IUPAC NameN-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide
SMILESCCOc1ccccc1C(=O)Nc1cc(OC)c(OC)cc1Cl
InChIInChI=1S/C17H18ClNO4/c1-4-23-14-8-6-5-7-11(14)17(20)19-13-10-16(22-3)15(21-2)9-12(13)18/h5-10H,4H2,1-3H3,(H,19,20)
InChIKeyNAOKOBLXHBJWBF-UHFFFAOYSA-N
XLogP4.01
TPSA56.79 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.79
LogP ≤ 54.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(2-chloro-4,5-dimethoxyphenyl)-2-ethylsulfonylbenzamide
CID 24684132
N-(4-amino-2,5-diethoxyphenyl)-2-methoxybenzamide
CID 23464291
N-(3-chloro-2-methylphenyl)-2-ethoxybenzamide
CID 723566
N-(2-chloro-4-nitrophenyl)-2-ethoxybenzamide
CID 2931673
N-(2,4-dichlorophenyl)-2-methoxybenzamide
CID 814241
N-(2-ethoxyphenyl)-2-(2-methoxyethoxy)benzamide
CID 15943045
N-(2-amino-5-methoxyphenyl)-2-ethoxybenzamide
CID 63257836
2-ethoxy-N-[4-[(2-methoxyphenyl)carbamoyl]phenyl]benzamide
CID 26522658
N-(2,5-diethoxyphenyl)-2-ethoxybenzamide
CID 43000684
2-hydroxy-3-methoxy-N-(2,4,5-trichlorophenyl)benzamide
CID 29286272
2-[[2-(difluoromethoxy)benzoyl]amino]-4-ethoxy-5-methoxybenzoic acid
CID 8005134
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206

Frequently Asked Questions

What is the IUPAC name of N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide?
The IUPAC name of N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide (CID 30804314) is N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide.
What is the SMILES notation for N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide?
The canonical SMILES for N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide is CCOc1ccccc1C(=O)Nc1cc(OC)c(OC)cc1Cl.
What is the InChIKey of N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide?
The InChIKey is NAOKOBLXHBJWBF-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18ClNO4/c1-4-23-14-8-6-5-7-11(14)17(20)19-13-10-16(22-3)15(21-2)9-12(13)18/h5-10H,4H2,1-3H3,(H,19,20).
What are the key properties of N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide?
N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide has a molecular weight of 335.79 g/mol, XLogP of 4.01, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chloro-4,5-dimethoxyphenyl)-2-ethoxybenzamide is sourced from PubChem (CID 30804314), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).