N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide

C20H16N2O2S — CID 6620018

IUPACN,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCc1ccc2[nH]c(=O)c3cc(C(=O)N(C)c4ccccc4)sc3c2c1
InChIInChI=1S/C20H16N2O2S/c1-12-8-9-16-14(10-12)18-15(19(23)21-16)11-17(25-18)20(24)22(2)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,21,23)
InChIKeyCQXPIDKNTDTCQJ-UHFFFAOYSA-N
MW348.43 g/mol
LogP4.33
Rot. Bonds2

About N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide

N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide (PubChem CID 6620018) has the molecular formula C20H16N2O2S and a molecular weight of 348.43 g/mol. Its IUPAC name is N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide
PubChem CID6620018
Molecular FormulaC20H16N2O2S
Molecular Weight348.43 g/mol
Exact Mass348.09
IUPAC NameN,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide
SMILESCc1ccc2[nH]c(=O)c3cc(C(=O)N(C)c4ccccc4)sc3c2c1
InChIInChI=1S/C20H16N2O2S/c1-12-8-9-16-14(10-12)18-15(19(23)21-16)11-17(25-18)20(24)22(2)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,21,23)
InChIKeyCQXPIDKNTDTCQJ-UHFFFAOYSA-N
XLogP4.33
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.43
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide (CID 6620018) is N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide is Cc1ccc2[nH]c(=O)c3cc(C(=O)N(C)c4ccccc4)sc3c2c1.
What is the InChIKey of N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
The InChIKey is CQXPIDKNTDTCQJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H16N2O2S/c1-12-8-9-16-14(10-12)18-15(19(23)21-16)11-17(25-18)20(24)22(2)13-6-4-3-5-7-13/h3-11H,1-2H3,(H,21,23).
What are the key properties of N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide?
N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide has a molecular weight of 348.43 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,8-dimethyl-4-oxo-N-phenyl-5H-thieno[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 6620018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).