N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

C14H16N2O2S — CID 46396035

IUPACN-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESO=C(Cn1ccc2sccc2c1=O)NC1CCCC1
InChIInChI=1S/C14H16N2O2S/c17-13(15-10-3-1-2-4-10)9-16-7-5-12-11(14(16)18)6-8-19-12/h5-8,10H,1-4,9H2,(H,15,17)
InChIKeyBHKIAHVIPPPNDW-UHFFFAOYSA-N
MW276.36 g/mol
LogP2.12
Rot. Bonds3

About N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide

N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (PubChem CID 46396035) has the molecular formula C14H16N2O2S and a molecular weight of 276.36 g/mol. Its IUPAC name is N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.

Molecular Properties

Compound NameN-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
PubChem CID46396035
Molecular FormulaC14H16N2O2S
Molecular Weight276.36 g/mol
Exact Mass276.09
IUPAC NameN-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide
SMILESO=C(Cn1ccc2sccc2c1=O)NC1CCCC1
InChIInChI=1S/C14H16N2O2S/c17-13(15-10-3-1-2-4-10)9-16-7-5-12-11(14(16)18)6-8-19-12/h5-8,10H,1-4,9H2,(H,15,17)
InChIKeyBHKIAHVIPPPNDW-UHFFFAOYSA-N
XLogP2.12
TPSA51.10 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.36
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The IUPAC name of N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide (CID 46396035) is N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide.
What is the SMILES notation for N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The canonical SMILES for N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is O=C(Cn1ccc2sccc2c1=O)NC1CCCC1.
What is the InChIKey of N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
The InChIKey is BHKIAHVIPPPNDW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O2S/c17-13(15-10-3-1-2-4-10)9-16-7-5-12-11(14(16)18)6-8-19-12/h5-8,10H,1-4,9H2,(H,15,17).
What are the key properties of N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide?
N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide has a molecular weight of 276.36 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-(4-oxothieno[3,2-c]pyridin-5-yl)acetamide is sourced from PubChem (CID 46396035), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).