4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide

C22H29N3O2 — CID 155873379

IUPAC4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cccc(CN2CCC(Nc3ccccc3)(C(=O)N(C)C)CC2)c1
InChIInChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-9-5-4-6-10-19)12-14-25(15-13-22)17-18-8-7-11-20(16-18)27-3/h4-11,16,23H,12-15,17H2,1-3H3
InChIKeyVFARYPNNYMVCGW-UHFFFAOYSA-N
MW367.49 g/mol
LogP3.23
Rot. Bonds6

About 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide

4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 155873379) has the molecular formula C22H29N3O2 and a molecular weight of 367.49 g/mol. Its IUPAC name is 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
PubChem CID155873379
Molecular FormulaC22H29N3O2
Molecular Weight367.49 g/mol
Exact Mass367.23
IUPAC Name4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
SMILESCOc1cccc(CN2CCC(Nc3ccccc3)(C(=O)N(C)C)CC2)c1
InChIInChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-9-5-4-6-10-19)12-14-25(15-13-22)17-18-8-7-11-20(16-18)27-3/h4-11,16,23H,12-15,17H2,1-3H3
InChIKeyVFARYPNNYMVCGW-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

3-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878831
4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155878897
4-(3-methoxyanilino)-N,N-dimethyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-4-carboxamide
CID 155879928
1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide
CID 155879122
4-anilino-1-[(2-fluorophenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155879946
1-[(4-fluorophenyl)methyl]-4-(3-methoxyanilino)-N-methylpiperidine-4-carboxamide
CID 155879440
1-benzyl-4-(3-methylanilino)piperidine-4-carboxylic acid
CID 21193445
1-benzyl-4-((1,2,3,4,5,6-13C6)cyclohexatrienylamino)piperidine-4-carboxamide
CID 45040221
4-(3-fluoroanilino)-N,N-dimethyl-1-[(2-methylphenyl)methyl]piperidine-4-carboxamide
CID 155873984
methyl 1-ethyl-4-(3-methoxyanilino)piperidine-4-carboxylate
CID 60993286
3-anilino-N,N-dimethyl-1-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 155879167
1-[(2-fluorophenyl)methyl]-4-(3-methoxyanilino)-N-methylpiperidine-4-carboxamide
CID 155880014

Frequently Asked Questions

What is the IUPAC name of 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide (CID 155873379) is 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide is COc1cccc(CN2CCC(Nc3ccccc3)(C(=O)N(C)C)CC2)c1.
What is the InChIKey of 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is VFARYPNNYMVCGW-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H29N3O2/c1-24(2)21(26)22(23-19-9-5-4-6-10-19)12-14-25(15-13-22)17-18-8-7-11-20(16-18)27-3/h4-11,16,23H,12-15,17H2,1-3H3.
What are the key properties of 4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide?
4-anilino-1-[(3-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-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 155873379), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).