N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide

C20H18N2O3S — CID 1293625

IUPACN-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C20H18N2O3S/c1-25-17-6-3-2-5-14(17)13-19(23)21-15-8-10-16(11-9-15)22-20(24)18-7-4-12-26-18/h2-12H,13H2,1H3,(H,21,23)(H,22,24)
InChIKeyFCSQYVAEKRZVNO-UHFFFAOYSA-N
MW366.44 g/mol
LogP4.19
Rot. Bonds6

About N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide

N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide (PubChem CID 1293625) has the molecular formula C20H18N2O3S and a molecular weight of 366.44 g/mol. Its IUPAC name is N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
PubChem CID1293625
Molecular FormulaC20H18N2O3S
Molecular Weight366.44 g/mol
Exact Mass366.10
IUPAC NameN-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide
SMILESCOc1ccccc1CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1
InChIInChI=1S/C20H18N2O3S/c1-25-17-6-3-2-5-14(17)13-19(23)21-15-8-10-16(11-9-15)22-20(24)18-7-4-12-26-18/h2-12H,13H2,1H3,(H,21,23)(H,22,24)
InChIKeyFCSQYVAEKRZVNO-UHFFFAOYSA-N
XLogP4.19
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 ≤ 54.19
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide (CID 1293625) is N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide is COc1ccccc1CC(=O)Nc1ccc(NC(=O)c2cccs2)cc1.
What is the InChIKey of N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
The InChIKey is FCSQYVAEKRZVNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H18N2O3S/c1-25-17-6-3-2-5-14(17)13-19(23)21-15-8-10-16(11-9-15)22-20(24)18-7-4-12-26-18/h2-12H,13H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide?
N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide has a molecular weight of 366.44 g/mol, XLogP of 4.19, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[[2-(2-methoxyphenyl)acetyl]amino]phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 1293625), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).