N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide

C23H24ClN3O2 — CID 16614527

IUPACN-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(Cl)ccc1N1CCCCC1
InChIInChI=1S/C23H24ClN3O2/c1-16-19(26-23(29-16)17-8-4-2-5-9-17)15-22(28)25-20-14-18(24)10-11-21(20)27-12-6-3-7-13-27/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3,(H,25,28)
InChIKeyPQTCCHXMUBGFMU-UHFFFAOYSA-N
MW409.92 g/mol
LogP5.47
Rot. Bonds5

About N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide

N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide (PubChem CID 16614527) has the molecular formula C23H24ClN3O2 and a molecular weight of 409.92 g/mol. Its IUPAC name is N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide.

Molecular Properties

Compound NameN-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
PubChem CID16614527
Molecular FormulaC23H24ClN3O2
Molecular Weight409.92 g/mol
Exact Mass409.16
IUPAC NameN-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
SMILESCc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(Cl)ccc1N1CCCCC1
InChIInChI=1S/C23H24ClN3O2/c1-16-19(26-23(29-16)17-8-4-2-5-9-17)15-22(28)25-20-14-18(24)10-11-21(20)27-12-6-3-7-13-27/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3,(H,25,28)
InChIKeyPQTCCHXMUBGFMU-UHFFFAOYSA-N
XLogP5.47
TPSA58.37 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500409.92
LogP ≤ 55.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(5-chloro-2-pyrrolidin-1-ylphenyl)-2-phenylacetamide
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N-(5-chloro-2-piperidin-1-ylphenyl)-3-(3-phenyl-1,2,4-oxadiazol-5-yl)propanamide
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2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(3-pyrrolidin-1-ylquinoxalin-2-yl)acetamide
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2-[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]-N-(2-morpholin-4-ylphenyl)acetamide
CID 110425209
N-(4-chloro-3-piperidin-1-ylsulfonylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
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N-(3-bromo-5-chloro-2-ethoxyphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
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2-(benzenesulfonyl)-N-(5-chloro-2-piperidin-1-ylphenyl)acetamide
CID 3917226
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(phenylcarbamoylamino)acetamide
CID 17459535
N-[2-(4-chlorophenyl)sulfanylethyl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
CID 30396724
3-(5-methyl-2-phenyl-1,3-oxazol-4-yl)-N-(2-morpholin-4-ylphenyl)propanamide
CID 110650823
N-[(4R)-6-chloro-3,4-dihydro-2H-thiochromen-4-yl]-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide
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Frequently Asked Questions

What is the IUPAC name of N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide?
The IUPAC name of N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide (CID 16614527) is N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide.
What is the SMILES notation for N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide?
The canonical SMILES for N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide is Cc1oc(-c2ccccc2)nc1CC(=O)Nc1cc(Cl)ccc1N1CCCCC1.
What is the InChIKey of N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide?
The InChIKey is PQTCCHXMUBGFMU-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H24ClN3O2/c1-16-19(26-23(29-16)17-8-4-2-5-9-17)15-22(28)25-20-14-18(24)10-11-21(20)27-12-6-3-7-13-27/h2,4-5,8-11,14H,3,6-7,12-13,15H2,1H3,(H,25,28).
What are the key properties of N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide?
N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide has a molecular weight of 409.92 g/mol, XLogP of 5.47, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(5-chloro-2-piperidin-1-ylphenyl)-2-(5-methyl-2-phenyl-1,3-oxazol-4-yl)acetamide is sourced from PubChem (CID 16614527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).