5-chloro-N-morpholin-4-ylthiophene-2-carboxamide

C9H11ClN2O2S — CID 819246

IUPAC5-chloro-N-morpholin-4-ylthiophene-2-carboxamide
SMILESO=C(NN1CCOCC1)c1ccc(Cl)s1
InChIInChI=1S/C9H11ClN2O2S/c10-8-2-1-7(15-8)9(13)11-12-3-5-14-6-4-12/h1-2H,3-6H2,(H,11,13)
InChIKeyCLCDWMCWGSUMCA-UHFFFAOYSA-N
MW246.72 g/mol
LogP1.38
Rot. Bonds2

About 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide

5-chloro-N-morpholin-4-ylthiophene-2-carboxamide (PubChem CID 819246) has the molecular formula C9H11ClN2O2S and a molecular weight of 246.72 g/mol. Its IUPAC name is 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide.

Molecular Properties

Compound Name5-chloro-N-morpholin-4-ylthiophene-2-carboxamide
PubChem CID819246
Molecular FormulaC9H11ClN2O2S
Molecular Weight246.72 g/mol
Exact Mass246.02
IUPAC Name5-chloro-N-morpholin-4-ylthiophene-2-carboxamide
SMILESO=C(NN1CCOCC1)c1ccc(Cl)s1
InChIInChI=1S/C9H11ClN2O2S/c10-8-2-1-7(15-8)9(13)11-12-3-5-14-6-4-12/h1-2H,3-6H2,(H,11,13)
InChIKeyCLCDWMCWGSUMCA-UHFFFAOYSA-N
XLogP1.38
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.72
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-chloro-N-(4-methylpiperazin-1-yl)thiophene-2-carboxamide
CID 1246503
5-bromo-N-4-morpholinyl-2-thiophenecarboxamide
CID 1246814
5-chloro-N-(3-morpholin-4-ylpropyl)thiophene-2-carboxamide
CID 2712625
4-(5-Chlorothiophene-2-carbonyl)morpholine
CID 2225446
N-morpholin-4-ylthiophene-2-carboxamide
CID 819242
5-chloro-N'-(morpholine-4-carbothioyl)thiophene-2-carbohydrazide
CID 11587575
N'-(3-morpholin-4-ylpropanoyl)thiophene-2-carbohydrazide
CID 2337428
N'-(2-morpholin-4-ylacetyl)thiophene-2-carbohydrazide
CID 2725903
5-chloro-N-[2-(morpholin-4-yl)ethyl]thiophene-2-carboxamide
CID 17217345
N'-(5-chlorothiophene-2-carbonyl)morpholine-4-carbohydrazide
CID 11659292
5-(Morpholine-4-carbonyl)thiophene-2-carbohydrazide
CID 57688130
5-methyl-N-morpholin-4-ylthiophene-2-carboxamide
CID 57701915

Frequently Asked Questions

What is the IUPAC name of 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide?
The IUPAC name of 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide (CID 819246) is 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide.
What is the SMILES notation for 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide?
The canonical SMILES for 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide is O=C(NN1CCOCC1)c1ccc(Cl)s1.
What is the InChIKey of 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide?
The InChIKey is CLCDWMCWGSUMCA-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H11ClN2O2S/c10-8-2-1-7(15-8)9(13)11-12-3-5-14-6-4-12/h1-2H,3-6H2,(H,11,13).
What are the key properties of 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide?
5-chloro-N-morpholin-4-ylthiophene-2-carboxamide has a molecular weight of 246.72 g/mol, XLogP of 1.38, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-chloro-N-morpholin-4-ylthiophene-2-carboxamide is sourced from PubChem (CID 819246), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).