2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide

C24H25N3O3 — CID 10150826

IUPAC2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
SMILESO=C(Cc1ccccc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C24H25N3O3/c28-22(15-18-7-3-1-4-8-18)25-16-19-9-11-20(12-10-19)23-26-21(17-30-23)24(29)27-13-5-2-6-14-27/h1,3-4,7-12,17H,2,5-6,13-16H2,(H,25,28)
InChIKeyYSNICWIWJRABSY-UHFFFAOYSA-N
MW403.48 g/mol
LogP3.83
Rot. Bonds6

About 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide

2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide (PubChem CID 10150826) has the molecular formula C24H25N3O3 and a molecular weight of 403.48 g/mol. Its IUPAC name is 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
PubChem CID10150826
Molecular FormulaC24H25N3O3
Molecular Weight403.48 g/mol
Exact Mass403.19
IUPAC Name2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
SMILESO=C(Cc1ccccc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C24H25N3O3/c28-22(15-18-7-3-1-4-8-18)25-16-19-9-11-20(12-10-19)23-26-21(17-30-23)24(29)27-13-5-2-6-14-27/h1,3-4,7-12,17H,2,5-6,13-16H2,(H,25,28)
InChIKeyYSNICWIWJRABSY-UHFFFAOYSA-N
XLogP3.83
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms30
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500403.48
LogP ≤ 53.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The IUPAC name of 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide (CID 10150826) is 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide.
What is the SMILES notation for 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The canonical SMILES for 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide is O=C(Cc1ccccc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1.
What is the InChIKey of 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The InChIKey is YSNICWIWJRABSY-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H25N3O3/c28-22(15-18-7-3-1-4-8-18)25-16-19-9-11-20(12-10-19)23-26-21(17-30-23)24(29)27-13-5-2-6-14-27/h1,3-4,7-12,17H,2,5-6,13-16H2,(H,25,28).
What are the key properties of 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide has a molecular weight of 403.48 g/mol, XLogP of 3.83, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenyl-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide is sourced from PubChem (CID 10150826), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).