N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide

C20H18ClNO2S — CID 35341413

IUPACN-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide
SMILESCCOc1ccccc1C(=O)N(Cc1cccs1)c1ccccc1Cl
InChIInChI=1S/C20H18ClNO2S/c1-2-24-19-12-6-3-9-16(19)20(23)22(14-15-8-7-13-25-15)18-11-5-4-10-17(18)21/h3-13H,2,14H2,1H3
InChIKeyWFHQFLUJZMYEEC-UHFFFAOYSA-N
MW371.89 g/mol
LogP5.65
Rot. Bonds6

About N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide

N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide (PubChem CID 35341413) has the molecular formula C20H18ClNO2S and a molecular weight of 371.89 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide
PubChem CID35341413
Molecular FormulaC20H18ClNO2S
Molecular Weight371.89 g/mol
Exact Mass371.07
IUPAC NameN-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide
SMILESCCOc1ccccc1C(=O)N(Cc1cccs1)c1ccccc1Cl
InChIInChI=1S/C20H18ClNO2S/c1-2-24-19-12-6-3-9-16(19)20(23)22(14-15-8-7-13-25-15)18-11-5-4-10-17(18)21/h3-13H,2,14H2,1H3
InChIKeyWFHQFLUJZMYEEC-UHFFFAOYSA-N
XLogP5.65
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500371.89
LogP ≤ 55.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

2-ethoxy-N-[2-[ethyl(thiophen-2-ylmethyl)amino]-2-oxoethyl]benzamide
CID 18163395
N-(4-ethylphenyl)-2-methoxy-N-(thiophen-2-ylmethyl)benzamide
CID 35180793
N-[(2-chlorophenyl)methyl]-2-ethoxy-N-pyridin-2-ylbenzamide
CID 35576771
2-ethoxy-N-(oxan-4-yl)-N-(2-thiophen-2-ylethyl)benzamide
CID 90610971
2-chloro-N-(3-chloro-2-methylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 39456181
1-(2-methoxyphenyl)-2-[methyl(thiophen-2-ylmethyl)amino]ethanone
CID 60650482
2-chloro-N-(2-methylphenyl)-N-(thiophen-2-ylmethyl)acetamide
CID 39380130
2-[(2-chlorophenyl)methyl-methylamino]-N-methyl-N-(thiophen-2-ylmethyl)acetamide
CID 78788041
2-[2-[ethyl(thiophen-2-ylmethyl)amino]ethoxy]benzoic acid
CID 61436692
N-(4-ethoxyphenyl)-N-(thiophen-2-ylmethyl)thiophene-2-carboxamide
CID 17013288
3,4-diethoxy-N-ethyl-N-(thiophen-2-ylmethyl)benzamide
CID 78801031
ethyl N-phenyl-N-(thiophen-2-ylmethyl)carbamate
CID 91149975

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide?
The IUPAC name of N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide (CID 35341413) is N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide?
The canonical SMILES for N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide is CCOc1ccccc1C(=O)N(Cc1cccs1)c1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide?
The InChIKey is WFHQFLUJZMYEEC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18ClNO2S/c1-2-24-19-12-6-3-9-16(19)20(23)22(14-15-8-7-13-25-15)18-11-5-4-10-17(18)21/h3-13H,2,14H2,1H3.
What are the key properties of N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide?
N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide has a molecular weight of 371.89 g/mol, XLogP of 5.65, 6 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-ethoxy-N-(thiophen-2-ylmethyl)benzamide is sourced from PubChem (CID 35341413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).