5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide

C18H25N3O2S — CID 53191619

IUPAC5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc2cn(C3CCCC3)cc2s1
InChIInChI=1S/C18H25N3O2S/c22-18(19-5-6-20-7-9-23-10-8-20)16-11-14-12-21(13-17(14)24-16)15-3-1-2-4-15/h11-13,15H,1-10H2,(H,19,22)
InChIKeyKKYUNPVTMHBLDG-UHFFFAOYSA-N
MW347.48 g/mol
LogP2.88
Rot. Bonds5

About 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide

5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide (PubChem CID 53191619) has the molecular formula C18H25N3O2S and a molecular weight of 347.48 g/mol. Its IUPAC name is 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide.

Molecular Properties

Compound Name5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide
PubChem CID53191619
Molecular FormulaC18H25N3O2S
Molecular Weight347.48 g/mol
Exact Mass347.17
IUPAC Name5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide
SMILESO=C(NCCN1CCOCC1)c1cc2cn(C3CCCC3)cc2s1
InChIInChI=1S/C18H25N3O2S/c22-18(19-5-6-20-7-9-23-10-8-20)16-11-14-12-21(13-17(14)24-16)15-3-1-2-4-15/h11-13,15H,1-10H2,(H,19,22)
InChIKeyKKYUNPVTMHBLDG-UHFFFAOYSA-N
XLogP2.88
TPSA46.50 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500347.48
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide?
The IUPAC name of 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide (CID 53191619) is 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide.
What is the SMILES notation for 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide?
The canonical SMILES for 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide is O=C(NCCN1CCOCC1)c1cc2cn(C3CCCC3)cc2s1.
What is the InChIKey of 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide?
The InChIKey is KKYUNPVTMHBLDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N3O2S/c22-18(19-5-6-20-7-9-23-10-8-20)16-11-14-12-21(13-17(14)24-16)15-3-1-2-4-15/h11-13,15H,1-10H2,(H,19,22).
What are the key properties of 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide?
5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide has a molecular weight of 347.48 g/mol, XLogP of 2.88, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-cyclopentyl-N-(2-morpholin-4-ylethyl)thieno[2,3-c]pyrrole-2-carboxamide is sourced from PubChem (CID 53191619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).