N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide

C20H22N2O2S — CID 15995877

IUPACN-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
SMILESCN(C(=O)c1cc2c(=O)n(C)c3ccccc3c2s1)C1CCCCC1
InChIInChI=1S/C20H22N2O2S/c1-21(13-8-4-3-5-9-13)20(24)17-12-15-18(25-17)14-10-6-7-11-16(14)22(2)19(15)23/h6-7,10-13H,3-5,8-9H2,1-2H3
InChIKeyNTPFJMDHBWNKEZ-UHFFFAOYSA-N
MW354.48 g/mol
LogP4.16
Rot. Bonds2

About N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide

N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide (PubChem CID 15995877) has the molecular formula C20H22N2O2S and a molecular weight of 354.48 g/mol. Its IUPAC name is N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
PubChem CID15995877
Molecular FormulaC20H22N2O2S
Molecular Weight354.48 g/mol
Exact Mass354.14
IUPAC NameN-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
SMILESCN(C(=O)c1cc2c(=O)n(C)c3ccccc3c2s1)C1CCCCC1
InChIInChI=1S/C20H22N2O2S/c1-21(13-8-4-3-5-9-13)20(24)17-12-15-18(25-17)14-10-6-7-11-16(14)22(2)19(15)23/h6-7,10-13H,3-5,8-9H2,1-2H3
InChIKeyNTPFJMDHBWNKEZ-UHFFFAOYSA-N
XLogP4.16
TPSA42.31 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.48
LogP ≤ 54.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-cyclohexyl-N,5-dimethyl-4-oxothieno[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-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide (CID 15995877) is N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide is CN(C(=O)c1cc2c(=O)n(C)c3ccccc3c2s1)C1CCCCC1.
What is the InChIKey of N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The InChIKey is NTPFJMDHBWNKEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2S/c1-21(13-8-4-3-5-9-13)20(24)17-12-15-18(25-17)14-10-6-7-11-16(14)22(2)19(15)23/h6-7,10-13H,3-5,8-9H2,1-2H3.
What are the key properties of N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide has a molecular weight of 354.48 g/mol, XLogP of 4.16, 2 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclohexyl-N,5-dimethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 15995877), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).