2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide

C19H17NO2S — CID 8820676

IUPAC2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
SMILESO=C(COc1ccccc1)N[C@@H](c1ccccc1)c1cccs1
InChIInChI=1S/C19H17NO2S/c21-18(14-22-16-10-5-2-6-11-16)20-19(17-12-7-13-23-17)15-8-3-1-4-9-15/h1-13,19H,14H2,(H,20,21)/t19-/m0/s1
InChIKeyUEIVBBNNTSEBNM-IBGZPJMESA-N
MW323.42 g/mol
LogP4.03
Rot. Bonds6

About 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide

2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide (PubChem CID 8820676) has the molecular formula C19H17NO2S and a molecular weight of 323.42 g/mol. Its IUPAC name is 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide.

Molecular Properties

Compound Name2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
PubChem CID8820676
Molecular FormulaC19H17NO2S
Molecular Weight323.42 g/mol
Exact Mass323.10
IUPAC Name2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
SMILESO=C(COc1ccccc1)N[C@@H](c1ccccc1)c1cccs1
InChIInChI=1S/C19H17NO2S/c21-18(14-22-16-10-5-2-6-11-16)20-19(17-12-7-13-23-17)15-8-3-1-4-9-15/h1-13,19H,14H2,(H,20,21)/t19-/m0/s1
InChIKeyUEIVBBNNTSEBNM-IBGZPJMESA-N
XLogP4.03
TPSA38.33 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500323.42
LogP ≤ 54.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(4-cyanophenoxy)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 9012921
2-(3,5-dimethylphenoxy)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 8853783
2-(2-ethoxyphenoxy)-N-[(R)-phenyl(thiophen-2-yl)methyl]acetamide
CID 8853848
2-(2-fluorophenoxy)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 9011592
2-(2-ethoxyphenoxy)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 8853842
2-ethoxy-N-[phenyl(thiophen-2-yl)methyl]acetamide
CID 60682552
2-(3-methylphenoxy)-N-[(S)-(4-methylphenyl)-thiophen-2-ylmethyl]acetamide
CID 8854678
N-[(S)-phenyl(thiophen-2-yl)methyl]-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]acetamide
CID 8866543
2-(2-chloro-4-cyanophenoxy)-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide
CID 8978027
[2-oxo-2-[[(R)-phenyl(thiophen-2-yl)methyl]amino]ethyl] (2S)-2-phenylbutanoate
CID 9230022
N-[(4-fluorophenyl)-thiophen-2-ylmethyl]-2-(3-methylphenoxy)acetamide
CID 17492974
[2-oxo-2-[[(S)-phenyl(thiophen-2-yl)methyl]amino]ethyl] (E)-but-2-enoate
CID 9081020

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?
The IUPAC name of 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide (CID 8820676) is 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide.
What is the SMILES notation for 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?
The canonical SMILES for 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide is O=C(COc1ccccc1)N[C@@H](c1ccccc1)c1cccs1.
What is the InChIKey of 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?
The InChIKey is UEIVBBNNTSEBNM-IBGZPJMESA-N. The full InChI is InChI=1S/C19H17NO2S/c21-18(14-22-16-10-5-2-6-11-16)20-19(17-12-7-13-23-17)15-8-3-1-4-9-15/h1-13,19H,14H2,(H,20,21)/t19-/m0/s1.
What are the key properties of 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide?
2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide has a molecular weight of 323.42 g/mol, XLogP of 4.03, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-[(S)-phenyl(thiophen-2-yl)methyl]acetamide is sourced from PubChem (CID 8820676), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).