N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide

C20H16N2O3S — CID 15990968

IUPACN-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc2c(=O)[nH]c3ccccc3c2s1
InChIInChI=1S/C20H16N2O3S/c1-2-25-16-10-6-5-9-15(16)22-20(24)17-11-13-18(26-17)12-7-3-4-8-14(12)21-19(13)23/h3-11H,2H2,1H3,(H,21,23)(H,22,24)
InChIKeyPKFNGWCYVJGASR-UHFFFAOYSA-N
MW364.43 g/mol
LogP4.39
Rot. Bonds4

About N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide

N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide (PubChem CID 15990968) has the molecular formula C20H16N2O3S and a molecular weight of 364.43 g/mol. Its IUPAC name is N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide
PubChem CID15990968
Molecular FormulaC20H16N2O3S
Molecular Weight364.43 g/mol
Exact Mass364.09
IUPAC NameN-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCCOc1ccccc1NC(=O)c1cc2c(=O)[nH]c3ccccc3c2s1
InChIInChI=1S/C20H16N2O3S/c1-2-25-16-10-6-5-9-15(16)22-20(24)17-11-13-18(26-17)12-7-3-4-8-14(12)21-19(13)23/h3-11H,2H2,1H3,(H,21,23)(H,22,24)
InChIKeyPKFNGWCYVJGASR-UHFFFAOYSA-N
XLogP4.39
TPSA71.19 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.43
LogP ≤ 54.39
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide (CID 15990968) is N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide is CCOc1ccccc1NC(=O)c1cc2c(=O)[nH]c3ccccc3c2s1.
What is the InChIKey of N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide?
The InChIKey is PKFNGWCYVJGASR-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O3S/c1-2-25-16-10-6-5-9-15(16)22-20(24)17-11-13-18(26-17)12-7-3-4-8-14(12)21-19(13)23/h3-11H,2H2,1H3,(H,21,23)(H,22,24).
What are the key properties of N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide?
N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide has a molecular weight of 364.43 g/mol, XLogP of 4.39, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-ethoxyphenyl)-4-oxo-5H-thieno[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 15990968), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).