N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide

C18H20N4O2S — CID 53187755

IUPACN-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCN(C3CCCC3)C2=O)nc1)c1ccsc1
InChIInChI=1S/C18H20N4O2S/c23-17(13-7-10-25-12-13)20-14-5-6-16(19-11-14)22-9-8-21(18(22)24)15-3-1-2-4-15/h5-7,10-12,15H,1-4,8-9H2,(H,20,23)
InChIKeyJJGDVXIISKYMOU-UHFFFAOYSA-N
MW356.45 g/mol
LogP3.58
Rot. Bonds4

About N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide

N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide (PubChem CID 53187755) has the molecular formula C18H20N4O2S and a molecular weight of 356.45 g/mol. Its IUPAC name is N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide.

Molecular Properties

Compound NameN-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide
PubChem CID53187755
Molecular FormulaC18H20N4O2S
Molecular Weight356.45 g/mol
Exact Mass356.13
IUPAC NameN-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide
SMILESO=C(Nc1ccc(N2CCN(C3CCCC3)C2=O)nc1)c1ccsc1
InChIInChI=1S/C18H20N4O2S/c23-17(13-7-10-25-12-13)20-14-5-6-16(19-11-14)22-9-8-21(18(22)24)15-3-1-2-4-15/h5-7,10-12,15H,1-4,8-9H2,(H,20,23)
InChIKeyJJGDVXIISKYMOU-UHFFFAOYSA-N
XLogP3.58
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500356.45
LogP ≤ 53.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide?
The IUPAC name of N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide (CID 53187755) is N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide.
What is the SMILES notation for N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide?
The canonical SMILES for N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide is O=C(Nc1ccc(N2CCN(C3CCCC3)C2=O)nc1)c1ccsc1.
What is the InChIKey of N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide?
The InChIKey is JJGDVXIISKYMOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N4O2S/c23-17(13-7-10-25-12-13)20-14-5-6-16(19-11-14)22-9-8-21(18(22)24)15-3-1-2-4-15/h5-7,10-12,15H,1-4,8-9H2,(H,20,23).
What are the key properties of N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide?
N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide has a molecular weight of 356.45 g/mol, XLogP of 3.58, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[6-(3-cyclopentyl-2-oxoimidazolidin-1-yl)-3-pyridinyl]thiophene-3-carboxamide is sourced from PubChem (CID 53187755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).