N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide

C19H20N2O2S — CID 6622578

IUPACN-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
SMILESCCn1c(=O)c2cc(C(=O)NC3CCCC3)sc2c2ccccc21
InChIInChI=1S/C19H20N2O2S/c1-2-21-15-10-6-5-9-13(15)17-14(19(21)23)11-16(24-17)18(22)20-12-7-3-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,20,22)
InChIKeyFGGOQVYLGXNSND-UHFFFAOYSA-N
MW340.45 g/mol
LogP3.91
Rot. Bonds3

About N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide

N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide (PubChem CID 6622578) has the molecular formula C19H20N2O2S and a molecular weight of 340.45 g/mol. Its IUPAC name is N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
PubChem CID6622578
Molecular FormulaC19H20N2O2S
Molecular Weight340.45 g/mol
Exact Mass340.12
IUPAC NameN-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide
SMILESCCn1c(=O)c2cc(C(=O)NC3CCCC3)sc2c2ccccc21
InChIInChI=1S/C19H20N2O2S/c1-2-21-15-10-6-5-9-13(15)17-14(19(21)23)11-16(24-17)18(22)20-12-7-3-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,20,22)
InChIKeyFGGOQVYLGXNSND-UHFFFAOYSA-N
XLogP3.91
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500340.45
LogP ≤ 53.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The IUPAC name of N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide (CID 6622578) is N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide.
What is the SMILES notation for N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The canonical SMILES for N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide is CCn1c(=O)c2cc(C(=O)NC3CCCC3)sc2c2ccccc21.
What is the InChIKey of N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
The InChIKey is FGGOQVYLGXNSND-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N2O2S/c1-2-21-15-10-6-5-9-13(15)17-14(19(21)23)11-16(24-17)18(22)20-12-7-3-4-8-12/h5-6,9-12H,2-4,7-8H2,1H3,(H,20,22).
What are the key properties of N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide?
N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide has a molecular weight of 340.45 g/mol, XLogP of 3.91, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-5-ethyl-4-oxothieno[3,2-c]quinoline-2-carboxamide is sourced from PubChem (CID 6622578), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).