N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide

C15H18N2O2S2 — CID 16931706

IUPACN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCC(c1ccsc1)N1CCOCC1)c1cccs1
InChIInChI=1S/C15H18N2O2S2/c18-15(14-2-1-8-21-14)16-10-13(12-3-9-20-11-12)17-4-6-19-7-5-17/h1-3,8-9,11,13H,4-7,10H2,(H,16,18)
InChIKeyUFAVFOLTDNUYDK-UHFFFAOYSA-N
MW322.45 g/mol
LogP2.61
Rot. Bonds5

About N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide

N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide (PubChem CID 16931706) has the molecular formula C15H18N2O2S2 and a molecular weight of 322.45 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide
PubChem CID16931706
Molecular FormulaC15H18N2O2S2
Molecular Weight322.45 g/mol
Exact Mass322.08
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide
SMILESO=C(NCC(c1ccsc1)N1CCOCC1)c1cccs1
InChIInChI=1S/C15H18N2O2S2/c18-15(14-2-1-8-21-14)16-10-13(12-3-9-20-11-12)17-4-6-19-7-5-17/h1-3,8-9,11,13H,4-7,10H2,(H,16,18)
InChIKeyUFAVFOLTDNUYDK-UHFFFAOYSA-N
XLogP2.61
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.45
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide (CID 16931706) is N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide is O=C(NCC(c1ccsc1)N1CCOCC1)c1cccs1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide?
The InChIKey is UFAVFOLTDNUYDK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2S2/c18-15(14-2-1-8-21-14)16-10-13(12-3-9-20-11-12)17-4-6-19-7-5-17/h1-3,8-9,11,13H,4-7,10H2,(H,16,18).
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide?
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide has a molecular weight of 322.45 g/mol, XLogP of 2.61, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide is sourced from PubChem (CID 16931706), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).