4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide

C20H23N3O4 — CID 7478742

IUPAC4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)cc1O
InChIInChI=1S/C20H23N3O4/c1-27-18-8-7-16(13-17(18)24)21-19(25)14-9-11-23(12-10-14)20(26)22-15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3,(H,21,25)(H,22,26)
InChIKeyIBEGIVYDVINKDY-UHFFFAOYSA-N
MW369.42 g/mol
LogP3.28
Rot. Bonds4

About 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide

4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide (PubChem CID 7478742) has the molecular formula C20H23N3O4 and a molecular weight of 369.42 g/mol. Its IUPAC name is 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide.

Molecular Properties

Compound Name4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
PubChem CID7478742
Molecular FormulaC20H23N3O4
Molecular Weight369.42 g/mol
Exact Mass369.17
IUPAC Name4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
SMILESCOc1ccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)cc1O
InChIInChI=1S/C20H23N3O4/c1-27-18-8-7-16(13-17(18)24)21-19(25)14-9-11-23(12-10-14)20(26)22-15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3,(H,21,25)(H,22,26)
InChIKeyIBEGIVYDVINKDY-UHFFFAOYSA-N
XLogP3.28
TPSA90.90 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.42
LogP ≤ 53.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

4-N-(3,4-dichlorophenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 26577149
4-N-(4-methyl-3-sulfamoylphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 55363749
(3S)-3-N-(3-chloro-4-methoxyphenyl)-1-N-phenylpiperidine-1,3-dicarboxamide
CID 26586333
4-N-[4,5-dimethoxy-2-(piperidine-1-carbonyl)phenyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 55638882
1-N-[(1R)-1-(2,5-dimethoxyphenyl)ethyl]-4-N-phenylpiperidine-1,4-dicarboxamide
CID 25490674
1-N,4-N-bis(3-methylphenyl)piperidine-1,4-dicarboxamide
CID 3222755
1-(8-methoxy-2-oxochromene-3-carbonyl)-N-phenylpiperidine-4-carboxamide
CID 26462498
1-(phenylcarbamoyl)piperidine-4-carboxylate
CID 2113074
4-N-[(2R)-2-(dimethylamino)-2-(2-methoxyphenyl)ethyl]-1-N-phenylpiperidine-1,4-dicarboxamide
CID 9220209
N-(3,4-dimethoxyphenyl)-1-(2-methylpropanoyl)piperidine-4-carboxamide
CID 32676956
1-[(3-methoxy-4-propan-2-yloxyphenyl)carbamoyl]piperidine-4-carboxylic acid
CID 122090112
4-N-(4-pentylphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide
CID 26776914

Frequently Asked Questions

What is the IUPAC name of 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide?
The IUPAC name of 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide (CID 7478742) is 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide.
What is the SMILES notation for 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide?
The canonical SMILES for 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide is COc1ccc(NC(=O)C2CCN(C(=O)Nc3ccccc3)CC2)cc1O.
What is the InChIKey of 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide?
The InChIKey is IBEGIVYDVINKDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H23N3O4/c1-27-18-8-7-16(13-17(18)24)21-19(25)14-9-11-23(12-10-14)20(26)22-15-5-3-2-4-6-15/h2-8,13-14,24H,9-12H2,1H3,(H,21,25)(H,22,26).
What are the key properties of 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide?
4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide has a molecular weight of 369.42 g/mol, XLogP of 3.28, 4 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-(3-hydroxy-4-methoxyphenyl)-1-N-phenylpiperidine-1,4-dicarboxamide is sourced from PubChem (CID 7478742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).