3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide

C14H21N3O4S2 — CID 119386595

IUPAC3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide
SMILESO=C(NC1CCNCC1)c1sccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C14H21N3O4S2/c18-14(16-11-1-4-15-5-2-11)13-12(3-10-22-13)23(19,20)17-6-8-21-9-7-17/h3,10-11,15H,1-2,4-9H2,(H,16,18)
InChIKeyFZIKQCLVNDLDNB-UHFFFAOYSA-N
MW359.47 g/mol
LogP0.25
Rot. Bonds4

About 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide

3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide (PubChem CID 119386595) has the molecular formula C14H21N3O4S2 and a molecular weight of 359.47 g/mol. Its IUPAC name is 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide
PubChem CID119386595
Molecular FormulaC14H21N3O4S2
Molecular Weight359.47 g/mol
Exact Mass359.10
IUPAC Name3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide
SMILESO=C(NC1CCNCC1)c1sccc1S(=O)(=O)N1CCOCC1
InChIInChI=1S/C14H21N3O4S2/c18-14(16-11-1-4-15-5-2-11)13-12(3-10-22-13)23(19,20)17-6-8-21-9-7-17/h3,10-11,15H,1-2,4-9H2,(H,16,18)
InChIKeyFZIKQCLVNDLDNB-UHFFFAOYSA-N
XLogP0.25
TPSA87.74 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 50.25
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide?
The IUPAC name of 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide (CID 119386595) is 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide.
What is the SMILES notation for 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide?
The canonical SMILES for 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide is O=C(NC1CCNCC1)c1sccc1S(=O)(=O)N1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide?
The InChIKey is FZIKQCLVNDLDNB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N3O4S2/c18-14(16-11-1-4-15-5-2-11)13-12(3-10-22-13)23(19,20)17-6-8-21-9-7-17/h3,10-11,15H,1-2,4-9H2,(H,16,18).
What are the key properties of 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide?
3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 0.25, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylsulfonyl-N-piperidin-4-ylthiophene-2-carboxamide is sourced from PubChem (CID 119386595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).