3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide

C21H26N4O2 — CID 155872887

IUPAC3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide
SMILESCc1cncc(C(=O)N2CCCC(Nc3ccccc3)(C(=O)N(C)C)C2)c1
InChIInChI=1S/C21H26N4O2/c1-16-12-17(14-22-13-16)19(26)25-11-7-10-21(15-25,20(27)24(2)3)23-18-8-5-4-6-9-18/h4-6,8-9,12-14,23H,7,10-11,15H2,1-3H3
InChIKeyVZTQNYXJZVZKCL-UHFFFAOYSA-N
MW366.47 g/mol
LogP2.57
Rot. Bonds4

About 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide

3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide (PubChem CID 155872887) has the molecular formula C21H26N4O2 and a molecular weight of 366.47 g/mol. Its IUPAC name is 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound Name3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide
PubChem CID155872887
Molecular FormulaC21H26N4O2
Molecular Weight366.47 g/mol
Exact Mass366.21
IUPAC Name3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide
SMILESCc1cncc(C(=O)N2CCCC(Nc3ccccc3)(C(=O)N(C)C)C2)c1
InChIInChI=1S/C21H26N4O2/c1-16-12-17(14-22-13-16)19(26)25-11-7-10-21(15-25,20(27)24(2)3)23-18-8-5-4-6-9-18/h4-6,8-9,12-14,23H,7,10-11,15H2,1-3H3
InChIKeyVZTQNYXJZVZKCL-UHFFFAOYSA-N
XLogP2.57
TPSA65.54 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.47
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

3-anilino-N,N-dimethyl-1-(thiophene-3-carbonyl)piperidine-3-carboxamide
CID 155873086
3-anilino-N,N-dimethyl-1-(pyridin-3-ylmethyl)piperidine-3-carboxamide
CID 155879167
(4-hydroxy-4-methylazepan-1-yl)-(5-methyl-3-pyridinyl)methanone
CID 107406442
3-anilino-N,N-dimethyl-1-(2-phenylethyl)piperidine-3-carboxamide;formic acid
CID 171692325
3-anilino-1-[(2-cyanophenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878993
4-anilino-N,N-dimethyl-1-(6-methylpyridine-2-carbonyl)piperidine-4-carboxamide
CID 155873229
3-anilino-1-[(3-methoxyphenyl)methyl]-N,N-dimethylpiperidine-3-carboxamide
CID 155878831
(3S)-3-hydroxy-1-[5-(3-methylphenyl)pyridine-3-carbonyl]piperidine-3-carboxamide
CID 129485829
4-anilino-N,N-dimethyl-1-(2-methyl-1,3-thiazole-4-carbonyl)piperidine-4-carboxamide
CID 155873454
N-(3-methylphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102907
4-anilino-N,N-dimethyl-1-(2-methylpyrazole-3-carbonyl)piperidine-4-carboxamide
CID 155874172
1-benzyl-3-ethyl-8-(5-methylpyridine-3-carbonyl)-1,3,8-triazaspiro[4.5]decane-2,4-dione
CID 166612321

Frequently Asked Questions

What is the IUPAC name of 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide?
The IUPAC name of 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide (CID 155872887) is 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide is Cc1cncc(C(=O)N2CCCC(Nc3ccccc3)(C(=O)N(C)C)C2)c1.
What is the InChIKey of 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide?
The InChIKey is VZTQNYXJZVZKCL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H26N4O2/c1-16-12-17(14-22-13-16)19(26)25-11-7-10-21(15-25,20(27)24(2)3)23-18-8-5-4-6-9-18/h4-6,8-9,12-14,23H,7,10-11,15H2,1-3H3.
What are the key properties of 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide?
3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide has a molecular weight of 366.47 g/mol, XLogP of 2.57, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-anilino-N,N-dimethyl-1-(5-methylpyridine-3-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 155872887), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).