N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide

C18H22N2O2S — CID 4124413

IUPACN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H22N2O2S/c21-18(13-15-5-2-1-3-6-15)19-14-16(17-7-4-12-23-17)20-8-10-22-11-9-20/h1-7,12,16H,8-11,13-14H2,(H,19,21)
InChIKeyYQSAHFIPGXMTGE-UHFFFAOYSA-N
MW330.45 g/mol
LogP2.48
Rot. Bonds6

About N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide (PubChem CID 4124413) has the molecular formula C18H22N2O2S and a molecular weight of 330.45 g/mol. Its IUPAC name is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide
PubChem CID4124413
Molecular FormulaC18H22N2O2S
Molecular Weight330.45 g/mol
Exact Mass330.14
IUPAC NameN-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide
SMILESO=C(Cc1ccccc1)NCC(c1cccs1)N1CCOCC1
InChIInChI=1S/C18H22N2O2S/c21-18(13-15-5-2-1-3-6-15)19-14-16(17-7-4-12-23-17)20-8-10-22-11-9-20/h1-7,12,16H,8-11,13-14H2,(H,19,21)
InChIKeyYQSAHFIPGXMTGE-UHFFFAOYSA-N
XLogP2.48
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.45
LogP ≤ 52.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide?
The IUPAC name of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide (CID 4124413) is N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide.
What is the SMILES notation for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide?
The canonical SMILES for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide is O=C(Cc1ccccc1)NCC(c1cccs1)N1CCOCC1.
What is the InChIKey of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide?
The InChIKey is YQSAHFIPGXMTGE-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H22N2O2S/c21-18(13-15-5-2-1-3-6-15)19-14-16(17-7-4-12-23-17)20-8-10-22-11-9-20/h1-7,12,16H,8-11,13-14H2,(H,19,21).
What are the key properties of N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide?
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide has a molecular weight of 330.45 g/mol, XLogP of 2.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-phenylacetamide is sourced from PubChem (CID 4124413), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).