N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide

C21H26N2O2 — CID 136519756

IUPACN-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide
SMILESCc1cccc(NC(=O)C(c2ccccc2)N2CCC(O)CC2)c1C
InChIInChI=1S/C21H26N2O2/c1-15-7-6-10-19(16(15)2)22-21(25)20(17-8-4-3-5-9-17)23-13-11-18(24)12-14-23/h3-10,18,20,24H,11-14H2,1-2H3,(H,22,25)
InChIKeyAZNKEJHFMPORSU-UHFFFAOYSA-N
MW338.45 g/mol
LogP3.44
Rot. Bonds4

About N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide

N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide (PubChem CID 136519756) has the molecular formula C21H26N2O2 and a molecular weight of 338.45 g/mol. Its IUPAC name is N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide.

Molecular Properties

Compound NameN-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide
PubChem CID136519756
Molecular FormulaC21H26N2O2
Molecular Weight338.45 g/mol
Exact Mass338.20
IUPAC NameN-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide
SMILESCc1cccc(NC(=O)C(c2ccccc2)N2CCC(O)CC2)c1C
InChIInChI=1S/C21H26N2O2/c1-15-7-6-10-19(16(15)2)22-21(25)20(17-8-4-3-5-9-17)23-13-11-18(24)12-14-23/h3-10,18,20,24H,11-14H2,1-2H3,(H,22,25)
InChIKeyAZNKEJHFMPORSU-UHFFFAOYSA-N
XLogP3.44
TPSA52.57 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500338.45
LogP ≤ 53.44
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(2R)-N-(2-ethoxyphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide
CID 29440121
2-(4-hydroxypiperidin-1-yl)-N-(6-methyl-3-pyridinyl)-2-phenylacetamide
CID 75503728
N,N'-bis(2,3-dimethylphenyl)-2-phenylpropanediamide
CID 3393245
ethane;1-(4-hydroxypiperidin-1-yl)-1-phenylpropan-2-one
CID 143630259
N-(2-ethoxyphenyl)-2-[(3S)-3-hydroxypyrrolidin-1-yl]-2-phenylacetamide
CID 111333839
2-amino-N-(2,3-dimethylphenyl)-2-phenylacetamide
CID 24694954
2-[(3R)-3-hydroxypyrrolidin-1-yl]-N-(2-methoxy-5-methylphenyl)-2-phenylacetamide
CID 111332556
1-(2,3-dimethylphenyl)-3-(1-propan-2-ylpiperidin-4-yl)urea
CID 6470893
2-(4-hydroxypiperidin-1-yl)-N-[3-(1-methyltetrazol-5-yl)phenyl]-2-phenylacetamide
CID 136519765
2-[4-[2-(2,3-dimethylanilino)-2-oxoethyl]piperazin-1-yl]-N-(ethylcarbamoyl)-2-phenylacetamide
CID 46614784
2-(4-chlorophenyl)-N-(2-methylphenyl)-2-pyrrolidin-1-ylacetamide
CID 3520877
N-(4-hydroxynaphthalen-2-yl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide
CID 166263336

Frequently Asked Questions

What is the IUPAC name of N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide?
The IUPAC name of N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide (CID 136519756) is N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide.
What is the SMILES notation for N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide?
The canonical SMILES for N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide is Cc1cccc(NC(=O)C(c2ccccc2)N2CCC(O)CC2)c1C.
What is the InChIKey of N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide?
The InChIKey is AZNKEJHFMPORSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N2O2/c1-15-7-6-10-19(16(15)2)22-21(25)20(17-8-4-3-5-9-17)23-13-11-18(24)12-14-23/h3-10,18,20,24H,11-14H2,1-2H3,(H,22,25).
What are the key properties of N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide?
N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide has a molecular weight of 338.45 g/mol, XLogP of 3.44, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2,3-dimethylphenyl)-2-(4-hydroxypiperidin-1-yl)-2-phenylacetamide is sourced from PubChem (CID 136519756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).