N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide

C20H18N2O3S — CID 31516964

IUPACN-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C20H18N2O3S/c1-2-25-17-10-4-3-9-16(17)19(23)21-14-7-5-8-15(13-14)22-20(24)18-11-6-12-26-18/h3-13H,2H2,1H3,(H,21,23)(H,22,24)
InChIKeyXGFGTYVKAFJZDP-UHFFFAOYSA-N
MW366.44 g/mol
LogP4.65
Rot. Bonds6

About N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide

N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide (PubChem CID 31516964) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
PubChem CID31516964
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC NameN-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
SMILESCCOc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1
InChIInChI=1S/C20H18N2O3S/c1-2-25-17-10-4-3-9-16(17)19(23)21-14-7-5-8-15(13-14)22-20(24)18-11-6-12-26-18/h3-13H,2H2,1H3,(H,21,23)(H,22,24)
InChIKeyXGFGTYVKAFJZDP-UHFFFAOYSA-N
XLogP4.65
TPSA67.43 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.44
LogP ≤ 54.65
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[3-[(3-chloro-4-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide
CID 1164621
N-(3-acetylphenyl)-2-ethoxybenzamide
CID 773754
N-[3-(naphthalene-1-carbonylamino)phenyl]thiophene-2-carboxamide
CID 1273133
2-ethoxy-N-(3-methoxyphenyl)benzamide
CID 760215
N-(3-carbamoylphenyl)-2-ethoxybenzamide
CID 25049798
2-ethoxy-N-[4-[(2-ethoxybenzoyl)amino]phenyl]benzamide
CID 1011206
2-ethoxy-N-[3-(1,3-thiazol-2-ylcarbamoyl)phenyl]benzamide
CID 9321520
2-ethoxy-N-[3-(1-hydroxyethyl)phenyl]benzamide
CID 43508405
N-[2-[(3-methoxyphenyl)carbamoyl]phenyl]thiophene-2-carboxamide
CID 24658002
methyl 2-[3-[(2-ethoxybenzoyl)amino]phenoxy]acetate
CID 46416869
2-ethoxy-N-[3-[(3-methylphenyl)carbamoyl]phenyl]benzamide
CID 1228354
N-(2-ethoxypyrimidin-5-yl)thiophene-2-carboxamide
CID 122301798

Frequently Asked Questions

What is the IUPAC name of N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide (CID 31516964) is N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide is CCOc1ccccc1C(=O)Nc1cccc(NC(=O)c2cccs2)c1.
What is the InChIKey of N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide?
The InChIKey is XGFGTYVKAFJZDP-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S/c1-2-25-17-10-4-3-9-16(17)19(23)21-14-7-5-8-15(13-14)22-20(24)18-11-6-12-26-18/h3-13H,2H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide?
N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide has a molecular weight of 366.44 g/mol, XLogP of 4.65, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[(2-ethoxybenzoyl)amino]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 31516964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).