2-phenyl-N-thiomorpholin-4-ylacetamide

C12H16N2OS — CID 67639755

IUPAC2-phenyl-N-thiomorpholin-4-ylacetamide
SMILESO=C(Cc1ccccc1)NN1CCSCC1
InChIInChI=1S/C12H16N2OS/c15-12(10-11-4-2-1-3-5-11)13-14-6-8-16-9-7-14/h1-5H,6-10H2,(H,13,15)
InChIKeyFTZASJZJYFCUKZ-UHFFFAOYSA-N
MW236.34 g/mol
LogP1.31
Rot. Bonds3

About 2-phenyl-N-thiomorpholin-4-ylacetamide

2-phenyl-N-thiomorpholin-4-ylacetamide (PubChem CID 67639755) has the molecular formula C12H16N2OS and a molecular weight of 236.34 g/mol. Its IUPAC name is 2-phenyl-N-thiomorpholin-4-ylacetamide.

Molecular Properties

Compound Name2-phenyl-N-thiomorpholin-4-ylacetamide
PubChem CID67639755
Molecular FormulaC12H16N2OS
Molecular Weight236.34 g/mol
Exact Mass236.10
IUPAC Name2-phenyl-N-thiomorpholin-4-ylacetamide
SMILESO=C(Cc1ccccc1)NN1CCSCC1
InChIInChI=1S/C12H16N2OS/c15-12(10-11-4-2-1-3-5-11)13-14-6-8-16-9-7-14/h1-5H,6-10H2,(H,13,15)
InChIKeyFTZASJZJYFCUKZ-UHFFFAOYSA-N
XLogP1.31
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.34
LogP ≤ 51.31
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

thiomorpholin-4-yl 2-phenylacetate
CID 174483517
2-[4-[2-(4-benzylpiperazin-1-yl)ethyl]phenyl]-1-thiomorpholin-4-ylethanone;dihydrochloride
CID 70468668
N-(3,5-dioxospiro[4-azatricyclo[5.2.1.02,6]dec-8-ene-10,1'-cyclopropane]-4-yl)-2-phenylacetamide
CID 2856874
4-ethyl-N-[2-[(2-phenylacetyl)amino]ethyl]piperazine-1-carboxamide
CID 60612186
N-[(1R,2S,6S,7S)-3,5-dioxo-4-azatricyclo[5.2.1.02,6]dec-8-en-4-yl]-2-phenylacetamide
CID 6543642
1-(azetidin-1-yl)-2-phenylethanone
CID 18670940
N-(5,6-dihydrobenzo[b][1]benzazepin-11-yl)-2-phenylacetamide
CID 3694017
N-[(2S)-1-oxo-1-(1,4-thiazepan-4-yl)pentan-2-yl]-2-phenylacetamide
CID 95171633
2-(2-hydroxyphenyl)-N-(4-methylpiperazin-1-yl)acetamide
CID 83016661
2-[4-[2-[(2-phenylacetyl)amino]acetyl]thiomorpholin-3-yl]acetic acid
CID 119210083
N-(6-methyl-7-oxo-5-phenyl-4-thia-1-azabicyclo[3.2.0]heptan-6-yl)-2-phenylacetamide
CID 3596529
2-phenyl-N-[[(2-phenylacetyl)amino]methyl]acetamide
CID 13210427

Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-thiomorpholin-4-ylacetamide?
The IUPAC name of 2-phenyl-N-thiomorpholin-4-ylacetamide (CID 67639755) is 2-phenyl-N-thiomorpholin-4-ylacetamide.
What is the SMILES notation for 2-phenyl-N-thiomorpholin-4-ylacetamide?
The canonical SMILES for 2-phenyl-N-thiomorpholin-4-ylacetamide is O=C(Cc1ccccc1)NN1CCSCC1.
What is the InChIKey of 2-phenyl-N-thiomorpholin-4-ylacetamide?
The InChIKey is FTZASJZJYFCUKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H16N2OS/c15-12(10-11-4-2-1-3-5-11)13-14-6-8-16-9-7-14/h1-5H,6-10H2,(H,13,15).
What are the key properties of 2-phenyl-N-thiomorpholin-4-ylacetamide?
2-phenyl-N-thiomorpholin-4-ylacetamide has a molecular weight of 236.34 g/mol, XLogP of 1.31, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-thiomorpholin-4-ylacetamide is sourced from PubChem (CID 67639755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).