4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide

C22H29N3O2 — CID 155878897

IUPAC4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1ccccc1CN1CCC(Nc2ccccc2)(C(=O)N(C)C)CC1
InChIInChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-10-5-4-6-11-19)13-15-25(16-14-22)17-18-9-7-8-12-20(18)27-3/h4-12,23H,13-17H2,1-3H3
InChIKeyKNPIYIFKPFXWIU-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.23
Rot. Bonds6

About 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide

4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 155878897) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
PubChem CID155878897
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1ccccc1CN1CCC(Nc2ccccc2)(C(=O)N(C)C)CC1
InChIInChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-10-5-4-6-11-19)13-15-25(16-14-22)17-18-9-7-8-12-20(18)27-3/h4-12,23H,13-17H2,1-3H3
InChIKeyKNPIYIFKPFXWIU-UHFFFAOYSA-N
XLogP3.23
TPSA44.81 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500367.49
LogP ≤ 53.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

4-anilino-1-[(2-fluorophenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155879946
4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155873379
4-(3-fluoroanilino)-N,N-dimethyl-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 155873984
4-(3-methoxyanilino)-N,N-dimethyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-4-carboxamide
CID 155879928
3-anilino-1-[(2-cyanophenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878993
3-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878831
1-[(2-chlorophenyl)methyl]-N,N-dimethyl-4-[(2-methylpyrazol-3-yl)amino]piperidine-4-carboxamide
CID 155878918
1-[(2-fluorophenyl)methyl]-4-(3-methoxyanilino)-N-methylpiperidine-4-carboxamide
CID 155880014
4-[(2-methoxyphenyl)methyl]-N-[[1-(pyrrolidin-1-ylmethyl)cyclopropyl]methyl]piperazine-1-carboxamide
CID 122564788
methyl (4S)-5-[4-anilino-1-(naphthalen-1-ylmethyl)piperidin-4-yl]-4-methyl-5-oxopentanoate
CID 146648671
1-benzyl-4-((1,2,3,4,5,6-13C6)cyclohexatrienylamino)piperidine-4-carboxamide
CID 45040221
[2-(piperidin-1-ylmethyl)phenyl] N,N-dimethylcarbamate
CID 11043577

Frequently Asked Questions

What is the IUPAC name of 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide (CID 155878897) is 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide is COc1ccccc1CN1CCC(Nc2ccccc2)(C(=O)N(C)C)CC1.
What is the InChIKey of 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is KNPIYIFKPFXWIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-10-5-4-6-11-19)13-15-25(16-14-22)17-18-9-7-8-12-20(18)27-3/h4-12,23H,13-17H2,1-3H3.
What are the key properties of 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 367.49 g/mol, XLogP of 3.23, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 155878897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).