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

C24H24ClN3O3 — CID 10151335

IUPAC2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C24H24ClN3O3/c25-20-10-6-17(7-11-20)14-22(29)26-15-18-4-8-19(9-5-18)23-27-21(16-31-23)24(30)28-12-2-1-3-13-28/h4-11,16H,1-3,12-15H2,(H,26,29)
InChIKeyANFBKPUUKOCDHK-UHFFFAOYSA-N
MW437.93 g/mol
LogP4.48
Rot. Bonds6

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

2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide (PubChem CID 10151335) has the molecular formula C24H24ClN3O3 and a molecular weight of 437.93 g/mol. Its IUPAC name is 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide.

Molecular Properties

Compound Name2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
PubChem CID10151335
Molecular FormulaC24H24ClN3O3
Molecular Weight437.93 g/mol
Exact Mass437.15
IUPAC Name2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide
SMILESO=C(Cc1ccc(Cl)cc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1
InChIInChI=1S/C24H24ClN3O3/c25-20-10-6-17(7-11-20)14-22(29)26-15-18-4-8-19(9-5-18)23-27-21(16-31-23)24(30)28-12-2-1-3-13-28/h4-11,16H,1-3,12-15H2,(H,26,29)
InChIKeyANFBKPUUKOCDHK-UHFFFAOYSA-N
XLogP4.48
TPSA75.44 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500437.93
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The IUPAC name of 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide (CID 10151335) is 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide.
What is the SMILES notation for 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The canonical SMILES for 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide is O=C(Cc1ccc(Cl)cc1)NCc1ccc(-c2nc(C(=O)N3CCCCC3)co2)cc1.
What is the InChIKey of 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
The InChIKey is ANFBKPUUKOCDHK-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H24ClN3O3/c25-20-10-6-17(7-11-20)14-22(29)26-15-18-4-8-19(9-5-18)23-27-21(16-31-23)24(30)28-12-2-1-3-13-28/h4-11,16H,1-3,12-15H2,(H,26,29).
What are the key properties of 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide?
2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide has a molecular weight of 437.93 g/mol, XLogP of 4.48, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-chlorophenyl)-N-[[4-[4-(piperidine-1-carbonyl)-1,3-oxazol-2-yl]phenyl]methyl]acetamide is sourced from PubChem (CID 10151335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).