N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide

C19H22N2O3S — CID 110348231

IUPACN-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide
SMILESC[C@H](NC(=O)Cc1cccs1)C(=O)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C19H22N2O3S/c1-14(20-18(22)12-16-8-5-11-25-16)19(23)21-9-10-24-17(13-21)15-6-3-2-4-7-15/h2-8,11,14,17H,9-10,12-13H2,1H3,(H,20,22)/t14-,17?/m0/s1
InChIKeyMJWPRUKHSLAJGC-MBIQTGHCSA-N
MW358.46 g/mol
LogP2.40
Rot. Bonds5

About N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide

N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide (PubChem CID 110348231) has the molecular formula C19H22N2O3S and a molecular weight of 358.46 g/mol. Its IUPAC name is N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide.

Molecular Properties

Compound NameN-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide
PubChem CID110348231
Molecular FormulaC19H22N2O3S
Molecular Weight358.46 g/mol
Exact Mass358.14
IUPAC NameN-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide
SMILESC[C@H](NC(=O)Cc1cccs1)C(=O)N1CCOC(c2ccccc2)C1
InChIInChI=1S/C19H22N2O3S/c1-14(20-18(22)12-16-8-5-11-25-16)19(23)21-9-10-24-17(13-21)15-6-3-2-4-7-15/h2-8,11,14,17H,9-10,12-13H2,1H3,(H,20,22)/t14-,17?/m0/s1
InChIKeyMJWPRUKHSLAJGC-MBIQTGHCSA-N
XLogP2.40
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500358.46
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[(2S)-2-phenylmorpholin-4-yl]-2-thiophen-2-ylethanone
CID 51641442
(2S)-1-[(2R)-2-phenylmorpholin-4-yl]-2-thiomorpholin-4-ylpropan-1-one
CID 124588141
N-[1-[2-(4-fluorophenyl)morpholin-4-yl]-1-oxopropan-2-yl]benzamide
CID 55564010
2-methyl-N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]benzenesulfonamide
CID 110348278
1-[2-(4-bromophenyl)morpholin-4-yl]-2-thiophen-2-ylethanone
CID 47913307
1-[2-[4-(dimethylamino)phenyl]morpholin-4-yl]-2-thiophen-2-ylethanone
CID 110364204
N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]butane-1-sulfonamide
CID 110348267
2-bromo-1-(2-phenylmorpholin-4-yl)butan-1-one
CID 62855050
(2S)-2-amino-1-(2-phenylmorpholin-4-yl)hexan-1-one
CID 103831208
2-amino-3-methoxy-1-(2-phenylmorpholin-4-yl)propan-1-one;hydrochloride
CID 120984965
5-phenyl-4-[(2-phenylmorpholine-4-carbonyl)amino]pentanoic acid
CID 122027308
2-methyl-N-[4-oxo-4-(2-phenylmorpholin-4-yl)butyl]propanamide
CID 16894893

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide?
The IUPAC name of N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide (CID 110348231) is N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide.
What is the SMILES notation for N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide?
The canonical SMILES for N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide is C[C@H](NC(=O)Cc1cccs1)C(=O)N1CCOC(c2ccccc2)C1.
What is the InChIKey of N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide?
The InChIKey is MJWPRUKHSLAJGC-MBIQTGHCSA-N. The full InChI is InChI=1S/C19H22N2O3S/c1-14(20-18(22)12-16-8-5-11-25-16)19(23)21-9-10-24-17(13-21)15-6-3-2-4-7-15/h2-8,11,14,17H,9-10,12-13H2,1H3,(H,20,22)/t14-,17?/m0/s1.
What are the key properties of N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide?
N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide has a molecular weight of 358.46 g/mol, XLogP of 2.40, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-oxo-1-(2-phenylmorpholin-4-yl)propan-2-yl]-2-thiophen-2-ylacetamide is sourced from PubChem (CID 110348231), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).