2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide

C21H25N3O3 — CID 3053603

IUPAC2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide
SMILESCc1ccc(NC(=O)NC(=O)CN2CCC(O)(c3ccccc3)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-16-7-9-18(10-8-16)22-20(26)23-19(25)15-24-13-11-21(27,12-14-24)17-5-3-2-4-6-17/h2-10,27H,11-15H2,1H3,(H2,22,23,25,26)
InChIKeyYMQKTWAUAKIGLF-UHFFFAOYSA-N
MW367.45 g/mol
LogP2.63
Rot. Bonds4

About 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide

2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide (PubChem CID 3053603) has the molecular formula C21H25N3O3 and a molecular weight of 367.45 g/mol. Its IUPAC name is 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide.

Molecular Properties

Compound Name2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide
PubChem CID3053603
Molecular FormulaC21H25N3O3
Molecular Weight367.45 g/mol
Exact Mass367.19
IUPAC Name2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide
SMILESCc1ccc(NC(=O)NC(=O)CN2CCC(O)(c3ccccc3)CC2)cc1
InChIInChI=1S/C21H25N3O3/c1-16-7-9-18(10-8-16)22-20(26)23-19(25)15-24-13-11-21(27,12-14-24)17-5-3-2-4-6-17/h2-10,27H,11-15H2,1H3,(H2,22,23,25,26)
InChIKeyYMQKTWAUAKIGLF-UHFFFAOYSA-N
XLogP2.63
TPSA81.67 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.45
LogP ≤ 52.63
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-[hydroxy(diphenyl)methyl]piperidin-1-yl]-N-phenylacetamide
CID 1967607
N-[4-(dimethylamino)phenyl]-2-(4-hydroxy-4-phenyl-piperidino)acetamide
CID 3228763
4-hydroxy-N-phenyl-4-[3-(trifluoromethyl)phenyl]-1-piperidinecarboxamide
CID 6459805
N-[(2,4-dimethylphenyl)carbamoyl]-2-[4-(4-hydroxyphenyl)piperazin-1-yl]acetamide
CID 8007471
6-(3-Ethyl-4-methyl-phenylamino)-3-[4-(4-hydroxy-4-phenyl-piperidin-1-yl)-butyl]-1H-pyrimidine-2,4-dione
CID 10928878
3-[(dimethylamino)methyl]-4-hydroxy-N,4-diphenylpiperidine-1-carboxamide;hydrochloride
CID 162655156
4-(4-fluorophenyl)-N-[3-fluoro-5-(trifluoromethyl)phenyl]-4-hydroxypiperidine-1-carboxamide
CID 23071955
4-(4-chlorophenyl)-4-hydroxy-N-(4-methylphenyl)piperidine-1-carboxamide
CID 650430
1-Piperidinecarboxanilide, 4-hydroxy-4-phenyl-thio-
CID 3050119
1-Piperidinecarbothioamide, 4-hydroxy-N-(2-methylphenyl)-4-phenyl-
CID 3050126
1-Piperidineacetamide, N-(((4-methylphenyl)amino)carbonyl)-4-phenyl-
CID 3052570
1-Piperidineacetamide, 4-hydroxy-4-phenyl-N-((phenylamino)carbonyl)-
CID 3053601

Frequently Asked Questions

What is the IUPAC name of 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide?
The IUPAC name of 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide (CID 3053603) is 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide.
What is the SMILES notation for 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide?
The canonical SMILES for 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide is Cc1ccc(NC(=O)NC(=O)CN2CCC(O)(c3ccccc3)CC2)cc1.
What is the InChIKey of 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide?
The InChIKey is YMQKTWAUAKIGLF-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H25N3O3/c1-16-7-9-18(10-8-16)22-20(26)23-19(25)15-24-13-11-21(27,12-14-24)17-5-3-2-4-6-17/h2-10,27H,11-15H2,1H3,(H2,22,23,25,26).
What are the key properties of 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide?
2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide has a molecular weight of 367.45 g/mol, XLogP of 2.63, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-hydroxy-4-phenylpiperidin-1-yl)-N-[(4-methylphenyl)carbamoyl]acetamide is sourced from PubChem (CID 3053603), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).