N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide

C17H19N3O — CID 154157313

IUPACN-phenyl-N-piperidin-1-ylpyridine-4-carboxamide
SMILESO=C(c1ccncc1)N(c1ccccc1)N1CCCCC1
InChIInChI=1S/C17H19N3O/c21-17(15-9-11-18-12-10-15)20(16-7-3-1-4-8-16)19-13-5-2-6-14-19/h1,3-4,7-12H,2,5-6,13-14H2
InChIKeyBXCJLGGUFCEVQS-UHFFFAOYSA-N
MW281.36 g/mol
LogP3.13
Rot. Bonds3

About N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide

N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide (PubChem CID 154157313) has the molecular formula C17H19N3O and a molecular weight of 281.36 g/mol. Its IUPAC name is N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide.

Molecular Properties

Compound NameN-phenyl-N-piperidin-1-ylpyridine-4-carboxamide
PubChem CID154157313
Molecular FormulaC17H19N3O
Molecular Weight281.36 g/mol
Exact Mass281.15
IUPAC NameN-phenyl-N-piperidin-1-ylpyridine-4-carboxamide
SMILESO=C(c1ccncc1)N(c1ccccc1)N1CCCCC1
InChIInChI=1S/C17H19N3O/c21-17(15-9-11-18-12-10-15)20(16-7-3-1-4-8-16)19-13-5-2-6-14-19/h1,3-4,7-12H,2,5-6,13-14H2
InChIKeyBXCJLGGUFCEVQS-UHFFFAOYSA-N
XLogP3.13
TPSA36.44 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 53.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide?
The IUPAC name of N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide (CID 154157313) is N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide.
What is the SMILES notation for N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide?
The canonical SMILES for N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide is O=C(c1ccncc1)N(c1ccccc1)N1CCCCC1.
What is the InChIKey of N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide?
The InChIKey is BXCJLGGUFCEVQS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O/c21-17(15-9-11-18-12-10-15)20(16-7-3-1-4-8-16)19-13-5-2-6-14-19/h1,3-4,7-12H,2,5-6,13-14H2.
What are the key properties of N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide?
N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide has a molecular weight of 281.36 g/mol, XLogP of 3.13, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-N-piperidin-1-ylpyridine-4-carboxamide is sourced from PubChem (CID 154157313), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).