5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide

C18H21N3O2 — CID 71730777

IUPAC5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide
SMILESCOc1ccc(-c2cncc(C(=O)NC3CCNCC3)c2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-17-4-2-13(3-5-17)14-10-15(12-20-11-14)18(22)21-16-6-8-19-9-7-16/h2-5,10-12,16,19H,6-9H2,1H3,(H,21,22)
InChIKeyLAUASDXCPCJMKK-UHFFFAOYSA-N
MW311.39 g/mol
LogP2.24
Rot. Bonds4

About 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide

5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide (PubChem CID 71730777) has the molecular formula C18H21N3O2 and a molecular weight of 311.39 g/mol. Its IUPAC name is 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide
PubChem CID71730777
Molecular FormulaC18H21N3O2
Molecular Weight311.39 g/mol
Exact Mass311.16
IUPAC Name5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide
SMILESCOc1ccc(-c2cncc(C(=O)NC3CCNCC3)c2)cc1
InChIInChI=1S/C18H21N3O2/c1-23-17-4-2-13(3-5-17)14-10-15(12-20-11-14)18(22)21-16-6-8-19-9-7-16/h2-5,10-12,16,19H,6-9H2,1H3,(H,21,22)
InChIKeyLAUASDXCPCJMKK-UHFFFAOYSA-N
XLogP2.24
TPSA63.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500311.39
LogP ≤ 52.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-(4-aminocyclohexyl)-5-(4-methoxyphenyl)pyridine-3-carboxamide;dihydrochloride
CID 119475519
5-(4-methylphenyl)-N-pyrrolidin-3-ylpyridine-3-carboxamide;dihydrochloride
CID 119452546
N-cyclopropyl-5-(6-methoxy-3-pyridinyl)pyridine-3-carboxamide
CID 117086611
N-cyclopropyl-5-(4-phenylphenyl)pyridine-3-carboxamide
CID 42845850
N-cyclohexyl-5-(4-methylphenyl)pyridine-3-carboxamide
CID 46032904
5-N-cyclopropyl-3-N-(2,4-dimethoxyphenyl)pyridine-3,5-dicarboxamide
CID 109101658
N-(4-methoxyphenyl)-5-phenylpyridine-3-carboxamide
CID 110683719
N-benzyl-5-(4-methoxyphenyl)pyridine-3-carboxamide
CID 53020816
7-[[5-(4-methoxyphenyl)pyridine-3-carbonyl]amino]heptanoic acid
CID 119350793
N-cyclopentyl-5-[2-(4-methoxyphenyl)ethylamino]pyridine-3-carboxamide
CID 109225918
N-cycloheptyl-5-[2-(4-methoxyphenoxy)ethylamino]pyridine-3-carboxamide
CID 109239199
3,9-diazabicyclo[4.2.1]nonan-3-yl-[5-(4-methoxyphenyl)-3-pyridinyl]methanone;dihydrochloride
CID 119636013

Frequently Asked Questions

What is the IUPAC name of 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide?
The IUPAC name of 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide (CID 71730777) is 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide?
The canonical SMILES for 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide is COc1ccc(-c2cncc(C(=O)NC3CCNCC3)c2)cc1.
What is the InChIKey of 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide?
The InChIKey is LAUASDXCPCJMKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21N3O2/c1-23-17-4-2-13(3-5-17)14-10-15(12-20-11-14)18(22)21-16-6-8-19-9-7-16/h2-5,10-12,16,19H,6-9H2,1H3,(H,21,22).
What are the key properties of 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide?
5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide has a molecular weight of 311.39 g/mol, XLogP of 2.24, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(4-methoxyphenyl)-N-piperidin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 71730777), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).