N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide

C19H23N3O3 — CID 109226574

IUPACN-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(N3CCCCC3)c2)cc1OC
InChIInChI=1S/C19H23N3O3/c1-24-17-7-6-15(11-18(17)25-2)21-19(23)14-10-16(13-20-12-14)22-8-4-3-5-9-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,21,23)
InChIKeyVHUSVNOAPFPQBG-UHFFFAOYSA-N
MW341.41 g/mol
LogP3.34
Rot. Bonds5

About N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide

N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide (PubChem CID 109226574) has the molecular formula C19H23N3O3 and a molecular weight of 341.41 g/mol. Its IUPAC name is N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide.

Molecular Properties

Compound NameN-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide
PubChem CID109226574
Molecular FormulaC19H23N3O3
Molecular Weight341.41 g/mol
Exact Mass341.17
IUPAC NameN-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide
SMILESCOc1ccc(NC(=O)c2cncc(N3CCCCC3)c2)cc1OC
InChIInChI=1S/C19H23N3O3/c1-24-17-7-6-15(11-18(17)25-2)21-19(23)14-10-16(13-20-12-14)22-8-4-3-5-9-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,21,23)
InChIKeyVHUSVNOAPFPQBG-UHFFFAOYSA-N
XLogP3.34
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500341.41
LogP ≤ 53.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-(4-acetamidophenyl)-5-(azepan-1-yl)pyridine-3-carboxamide
CID 109241376
5-piperidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 109226589
5-piperidin-1-yl-N-(4-piperidin-1-ylphenyl)pyridine-3-carboxamide
CID 109226590
N-(2-methoxy-5-methylphenyl)-5-piperidin-1-ylpyridine-3-carboxamide
CID 109226569
N-(4-acetamidophenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225827
2-(azepan-1-yl)-N-(3,4-dimethoxyphenyl)pyrimidine-5-carboxamide
CID 109265005
N-(3-chloro-4-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225803
5-(azepan-1-yl)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109241366
N-(3-methylphenyl)-5-pyrrolidin-1-ylpyridine-3-carboxamide
CID 109225773
N-(3-chlorophenyl)-5-piperidin-1-ylpyridine-3-carboxamide
CID 109226552
N-(3-chloro-4-methoxyphenyl)-5-(piperidine-1-carbonyl)pyridine-3-carboxamide
CID 109102940
N-(3,4-dimethoxyphenyl)-5-(2-methyl-2,3-dihydroindol-1-yl)pyridine-3-carboxamide
CID 109245677

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide?
The IUPAC name of N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide (CID 109226574) is N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide.
What is the SMILES notation for N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide?
The canonical SMILES for N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide is COc1ccc(NC(=O)c2cncc(N3CCCCC3)c2)cc1OC.
What is the InChIKey of N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide?
The InChIKey is VHUSVNOAPFPQBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O3/c1-24-17-7-6-15(11-18(17)25-2)21-19(23)14-10-16(13-20-12-14)22-8-4-3-5-9-22/h6-7,10-13H,3-5,8-9H2,1-2H3,(H,21,23).
What are the key properties of N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide?
N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide has a molecular weight of 341.41 g/mol, XLogP of 3.34, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethoxyphenyl)-5-piperidin-1-ylpyridine-3-carboxamide is sourced from PubChem (CID 109226574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).