1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide

C19H29N3O4 — CID 155879122

IUPAC1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(Nc2cccc(OC)c2)(C(=O)N(C)C)CC1
InChIInChI=1S/C19H29N3O4/c1-5-26-14-17(23)22-11-9-19(10-12-22,18(24)21(2)3)20-15-7-6-8-16(13-15)25-4/h6-8,13,20H,5,9-12,14H2,1-4H3
InChIKeyCMLBPOQJEOBPNN-UHFFFAOYSA-N
MW363.46 g/mol
LogP1.59
Rot. Bonds7

About 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide

1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide (PubChem CID 155879122) has the molecular formula C19H29N3O4 and a molecular weight of 363.46 g/mol. Its IUPAC name is 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide.

Molecular Properties

Compound Name1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide
PubChem CID155879122
Molecular FormulaC19H29N3O4
Molecular Weight363.46 g/mol
Exact Mass363.22
IUPAC Name1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide
SMILESCCOCC(=O)N1CCC(Nc2cccc(OC)c2)(C(=O)N(C)C)CC1
InChIInChI=1S/C19H29N3O4/c1-5-26-14-17(23)22-11-9-19(10-12-22,18(24)21(2)3)20-15-7-6-8-16(13-15)25-4/h6-8,13,20H,5,9-12,14H2,1-4H3
InChIKeyCMLBPOQJEOBPNN-UHFFFAOYSA-N
XLogP1.59
TPSA71.11 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500363.46
LogP ≤ 51.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155873379
4-(3-methoxyanilino)-N,N-dimethyl-1-[(5-methyl-1,2-oxazol-3-yl)methyl]piperidine-4-carboxamide
CID 155879928
methyl 1-ethyl-4-(3-methoxyanilino)piperidine-4-carboxylate
CID 60993286
1-(2-ethoxyacetyl)-4-(3-fluoroanilino)-N-propan-2-ylpiperidine-4-carboxamide
CID 155879755
4-anilino-1-[(2-methoxyphenyl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 155878897
3-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878831
ethyl 4-[2-(3-methoxyanilino)acetyl]piperazine-1-carboxylate
CID 109003882
ethyl 3-(3-methoxyanilino)thiolane-3-carboxylate
CID 54890596
1-(cyclobutanecarbonyl)-4-(3-methoxyanilino)-N-methylpiperidine-4-carboxamide
CID 155880079
[1-ethyl-4-(3-methoxyanilino)piperidin-4-yl]methanol
CID 61048674
ethyl 1-(3-methoxyanilino)-3-propan-2-ylcyclobutane-1-carboxylate
CID 103563491
4-anilino-N,N-dimethyl-1-[2-(triazol-1-yl)acetyl]piperidine-4-carboxamide
CID 155874156

Frequently Asked Questions

What is the IUPAC name of 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide?
The IUPAC name of 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide (CID 155879122) is 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide.
What is the SMILES notation for 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide?
The canonical SMILES for 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide is CCOCC(=O)N1CCC(Nc2cccc(OC)c2)(C(=O)N(C)C)CC1.
What is the InChIKey of 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide?
The InChIKey is CMLBPOQJEOBPNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H29N3O4/c1-5-26-14-17(23)22-11-9-19(10-12-22,18(24)21(2)3)20-15-7-6-8-16(13-15)25-4/h6-8,13,20H,5,9-12,14H2,1-4H3.
What are the key properties of 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide?
1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide has a molecular weight of 363.46 g/mol, XLogP of 1.59, 7 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-ethoxyacetyl)-4-(3-methoxyanilino)-N,N-dimethylpiperidine-4-carboxamide is sourced from PubChem (CID 155879122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).