3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide

C14H22N2O2S — CID 25162623

IUPAC3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C14H22N2O2S/c1-11-4-9-19-12(11)13(17)15-10-14(2,3)16-5-7-18-8-6-16/h4,9H,5-8,10H2,1-3H3,(H,15,17)
InChIKeyKBECORWCWXYKRA-UHFFFAOYSA-N
MW282.41 g/mol
LogP1.90
Rot. Bonds4

About 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide

3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide (PubChem CID 25162623) has the molecular formula C14H22N2O2S and a molecular weight of 282.41 g/mol. Its IUPAC name is 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide.

Molecular Properties

Compound Name3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
PubChem CID25162623
Molecular FormulaC14H22N2O2S
Molecular Weight282.41 g/mol
Exact Mass282.14
IUPAC Name3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide
SMILESCc1ccsc1C(=O)NCC(C)(C)N1CCOCC1
InChIInChI=1S/C14H22N2O2S/c1-11-4-9-19-12(11)13(17)15-10-14(2,3)16-5-7-18-8-6-16/h4,9H,5-8,10H2,1-3H3,(H,15,17)
InChIKeyKBECORWCWXYKRA-UHFFFAOYSA-N
XLogP1.90
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.41
LogP ≤ 51.90
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The IUPAC name of 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide (CID 25162623) is 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide.
What is the SMILES notation for 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The canonical SMILES for 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide is Cc1ccsc1C(=O)NCC(C)(C)N1CCOCC1.
What is the InChIKey of 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
The InChIKey is KBECORWCWXYKRA-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N2O2S/c1-11-4-9-19-12(11)13(17)15-10-14(2,3)16-5-7-18-8-6-16/h4,9H,5-8,10H2,1-3H3,(H,15,17).
What are the key properties of 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide?
3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide has a molecular weight of 282.41 g/mol, XLogP of 1.90, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-N-(2-methyl-2-morpholin-4-ylpropyl)thiophene-2-carboxamide is sourced from PubChem (CID 25162623), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).