2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide

C18H22N2O2S — CID 16931649

IUPAC2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
SMILESCc1ccccc1C(=O)NCC(c1ccsc1)N1CCOCC1
InChIInChI=1S/C18H22N2O2S/c1-14-4-2-3-5-16(14)18(21)19-12-17(15-6-11-23-13-15)20-7-9-22-10-8-20/h2-6,11,13,17H,7-10,12H2,1H3,(H,19,21)
InChIKeyAJAJLYZAYRNKCU-UHFFFAOYSA-N
MW330.45 g/mol
LogP2.86
Rot. Bonds5

About 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide

2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide (PubChem CID 16931649) has the molecular formula C18H22N2O2S and a molecular weight of 330.45 g/mol. Its IUPAC name is 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide.

Molecular Properties

Compound Name2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
PubChem CID16931649
Molecular FormulaC18H22N2O2S
Molecular Weight330.45 g/mol
Exact Mass330.14
IUPAC Name2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
SMILESCc1ccccc1C(=O)NCC(c1ccsc1)N1CCOCC1
InChIInChI=1S/C18H22N2O2S/c1-14-4-2-3-5-16(14)18(21)19-12-17(15-6-11-23-13-15)20-7-9-22-10-8-20/h2-6,11,13,17H,7-10,12H2,1H3,(H,19,21)
InChIKeyAJAJLYZAYRNKCU-UHFFFAOYSA-N
XLogP2.86
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 52.86
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[2-[(2-morpholin-4-yl-2-thiophen-3-ylethyl)carbamoyl]phenyl] acetate
CID 16931699
N-[(2S)-2-morpholin-4-yl-2-thiophen-3-ylethyl]benzamide
CID 30605183
2,3-dimethoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-3-ylethyl]benzamide
CID 29235413
2,6-difluoro-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
CID 16931663
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)thiophene-2-carboxamide
CID 16931706
N-[(2S)-2-morpholin-4-yl-2-thiophen-3-ylethyl]-4-phenylbenzamide
CID 30605147
N-[2-(3-methoxyphenyl)-2-morpholin-4-ylethyl]-2-methylbenzamide
CID 44902864
N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)-2-thiophen-2-ylacetamide
CID 16931688
2-methyl-N-(3-methyl-2-morpholin-4-ylbutyl)benzamide
CID 110402733
3,5-dimethoxy-N-[(2S)-2-morpholin-4-yl-2-thiophen-3-ylethyl]benzamide
CID 30604890
3,5-dimethoxy-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide
CID 16931647
2,4-dimethyl-N-[2-(4-methylpiperazin-1-yl)-2-thiophen-3-ylethyl]benzamide
CID 16931446

Frequently Asked Questions

What is the IUPAC name of 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide?
The IUPAC name of 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide (CID 16931649) is 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide.
What is the SMILES notation for 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide?
The canonical SMILES for 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide is Cc1ccccc1C(=O)NCC(c1ccsc1)N1CCOCC1.
What is the InChIKey of 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide?
The InChIKey is AJAJLYZAYRNKCU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c1-14-4-2-3-5-16(14)18(21)19-12-17(15-6-11-23-13-15)20-7-9-22-10-8-20/h2-6,11,13,17H,7-10,12H2,1H3,(H,19,21).
What are the key properties of 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide?
2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide has a molecular weight of 330.45 g/mol, XLogP of 2.86, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-N-(2-morpholin-4-yl-2-thiophen-3-ylethyl)benzamide is sourced from PubChem (CID 16931649), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).