N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide

C22H26N2O3 — CID 110347375

IUPACN-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C22H26N2O3/c25-21(17-27-19-12-6-2-7-13-19)23-20(16-18-10-4-1-5-11-18)22(26)24-14-8-3-9-15-24/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,25)/t20-/m0/s1
InChIKeyRTJCJMZUUYAYIZ-FQEVSTJZSA-N
MW366.46 g/mol
LogP2.81
Rot. Bonds7

About N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide

N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide (PubChem CID 110347375) has the molecular formula C22H26N2O3 and a molecular weight of 366.46 g/mol. Its IUPAC name is N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide.

Molecular Properties

Compound NameN-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide
PubChem CID110347375
Molecular FormulaC22H26N2O3
Molecular Weight366.46 g/mol
Exact Mass366.19
IUPAC NameN-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide
SMILESO=C(COc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1
InChIInChI=1S/C22H26N2O3/c25-21(17-27-19-12-6-2-7-13-19)23-20(16-18-10-4-1-5-11-18)22(26)24-14-8-3-9-15-24/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,25)/t20-/m0/s1
InChIKeyRTJCJMZUUYAYIZ-FQEVSTJZSA-N
XLogP2.81
TPSA58.64 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.46
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl)-2-phenylacetamide
CID 42696444
N-[(2S)-4-methyl-1-oxo-1-pyrrolidin-1-ylpentan-2-yl]-2-phenoxyacetamide
CID 110351364
2-amino-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide
CID 119310977
N-(4-methylsulfanyl-1-oxo-1-piperidin-1-ylbutan-2-yl)-2-phenoxyacetamide
CID 24820045
N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-3-phenylpropanamide
CID 110347374
(2R)-2-[(2-phenoxyacetyl)amino]-3-phenylpropanoic acid
CID 699216
N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]butanamide
CID 110347349
N-(1-oxo-1-pyrrolidin-1-ylpropan-2-yl)-2-phenoxyacetamide
CID 47101035
methyl N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]carbamate
CID 110347389
3-methoxy-N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]benzamide
CID 110347364
2-(cyclopropylmethylamino)-N-(1-oxo-3-phenyl-1-pyrrolidin-1-ylpropan-2-yl)acetamide;hydrochloride
CID 119762010
4-methoxy-N-(1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl)benzamide
CID 5021960

Frequently Asked Questions

What is the IUPAC name of N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide?
The IUPAC name of N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide (CID 110347375) is N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide.
What is the SMILES notation for N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide?
The canonical SMILES for N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide is O=C(COc1ccccc1)N[C@@H](Cc1ccccc1)C(=O)N1CCCCC1.
What is the InChIKey of N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide?
The InChIKey is RTJCJMZUUYAYIZ-FQEVSTJZSA-N. The full InChI is InChI=1S/C22H26N2O3/c25-21(17-27-19-12-6-2-7-13-19)23-20(16-18-10-4-1-5-11-18)22(26)24-14-8-3-9-15-24/h1-2,4-7,10-13,20H,3,8-9,14-17H2,(H,23,25)/t20-/m0/s1.
What are the key properties of N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide?
N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide has a molecular weight of 366.46 g/mol, XLogP of 2.81, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2S)-1-oxo-3-phenyl-1-piperidin-1-ylpropan-2-yl]-2-phenoxyacetamide is sourced from PubChem (CID 110347375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).