N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide

C23H25N3O3 — CID 53180365

IUPACN-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
SMILESO=C(Cn1cc(-c2ccccc2)oc1=O)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C23H25N3O3/c27-22(17-26-16-21(29-23(26)28)19-9-5-2-6-10-19)24-20-11-13-25(14-12-20)15-18-7-3-1-4-8-18/h1-10,16,20H,11-15,17H2,(H,24,27)
InChIKeyCQHXIJFZMFCWTM-UHFFFAOYSA-N
MW391.47 g/mol
LogP2.89
Rot. Bonds6

About N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide

N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide (PubChem CID 53180365) has the molecular formula C23H25N3O3 and a molecular weight of 391.47 g/mol. Its IUPAC name is N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide.

Molecular Properties

Compound NameN-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
PubChem CID53180365
Molecular FormulaC23H25N3O3
Molecular Weight391.47 g/mol
Exact Mass391.19
IUPAC NameN-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide
SMILESO=C(Cn1cc(-c2ccccc2)oc1=O)NC1CCN(Cc2ccccc2)CC1
InChIInChI=1S/C23H25N3O3/c27-22(17-26-16-21(29-23(26)28)19-9-5-2-6-10-19)24-20-11-13-25(14-12-20)15-18-7-3-1-4-8-18/h1-10,16,20H,11-15,17H2,(H,24,27)
InChIKeyCQHXIJFZMFCWTM-UHFFFAOYSA-N
XLogP2.89
TPSA67.48 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500391.47
LogP ≤ 52.89
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

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N-(1-benzylpiperidin-4-yl)-2-[(3R,5R)-3,5-dimethylpiperidin-1-yl]acetamide
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CID 11932070
N'-(1-benzylpiperidin-4-yl)butanediamide
CID 151114474
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CID 836236
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CID 22689014
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N-(1-benzylpyrrolidin-3-yl)-3-(5-phenylfuran-2-yl)propanamide
CID 18156265
N-(1-benzylpiperidin-4-yl)-2-(2-phenyl-1,3-oxazol-4-yl)acetamide
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CID 108812787

Frequently Asked Questions

What is the IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The IUPAC name of N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide (CID 53180365) is N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide.
What is the SMILES notation for N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The canonical SMILES for N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide is O=C(Cn1cc(-c2ccccc2)oc1=O)NC1CCN(Cc2ccccc2)CC1.
What is the InChIKey of N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
The InChIKey is CQHXIJFZMFCWTM-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H25N3O3/c27-22(17-26-16-21(29-23(26)28)19-9-5-2-6-10-19)24-20-11-13-25(14-12-20)15-18-7-3-1-4-8-18/h1-10,16,20H,11-15,17H2,(H,24,27).
What are the key properties of N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide?
N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide has a molecular weight of 391.47 g/mol, XLogP of 2.89, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-benzylpiperidin-4-yl)-2-(2-oxo-5-phenyl-1,3-oxazol-3-yl)acetamide is sourced from PubChem (CID 53180365), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).