2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide

C17H20N4O — CID 110862205

IUPAC2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(N3CCCCC3)cc2)ccn1
InChIInChI=1S/C17H20N4O/c18-16-12-13(8-9-19-16)17(22)20-14-4-6-15(7-5-14)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11H2,(H2,18,19)(H,20,22)
InChIKeyOMNZUSQQLBNKSH-UHFFFAOYSA-N
MW296.37 g/mol
LogP2.91
Rot. Bonds3

About 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide

2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide (PubChem CID 110862205) has the molecular formula C17H20N4O and a molecular weight of 296.37 g/mol. Its IUPAC name is 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide.

Molecular Properties

Compound Name2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
PubChem CID110862205
Molecular FormulaC17H20N4O
Molecular Weight296.37 g/mol
Exact Mass296.16
IUPAC Name2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
SMILESNc1cc(C(=O)Nc2ccc(N3CCCCC3)cc2)ccn1
InChIInChI=1S/C17H20N4O/c18-16-12-13(8-9-19-16)17(22)20-14-4-6-15(7-5-14)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11H2,(H2,18,19)(H,20,22)
InChIKeyOMNZUSQQLBNKSH-UHFFFAOYSA-N
XLogP2.91
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500296.37
LogP ≤ 52.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}

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Related Compounds

2-piperidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 109166232
N-(4-cyanophenyl)-2-(4-piperidin-1-ylanilino)pyridine-4-carboxamide
CID 109178749
N-(4-piperidin-1-ylphenyl)-4-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109080459
3,4-dichloro-N-(4-piperidin-1-ylphenyl)benzamide
CID 807268
2-(2-methoxyethylamino)-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
CID 109166955
2-amino-N-(4-chlorophenyl)pyridine-4-carboxamide
CID 62154696
2-[(5-methyl-1,2-oxazol-3-yl)amino]-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 109178731
2-(4-ethylpiperazin-1-yl)-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 109168800
2-(dipropylamino)-N-(4-pyrrolidin-1-ylphenyl)pyridine-4-carboxamide
CID 109175938
2-(3-cyanoanilino)-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide
CID 109178743
3-(piperidine-1-carbonyl)-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 109052099
5-piperidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyridine-3-carboxamide
CID 109226589

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide?
The IUPAC name of 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide (CID 110862205) is 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide.
What is the SMILES notation for 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide?
The canonical SMILES for 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide is Nc1cc(C(=O)Nc2ccc(N3CCCCC3)cc2)ccn1.
What is the InChIKey of 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide?
The InChIKey is OMNZUSQQLBNKSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20N4O/c18-16-12-13(8-9-19-16)17(22)20-14-4-6-15(7-5-14)21-10-2-1-3-11-21/h4-9,12H,1-3,10-11H2,(H2,18,19)(H,20,22).
What are the key properties of 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide?
2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide has a molecular weight of 296.37 g/mol, XLogP of 2.91, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-(4-piperidin-1-ylphenyl)pyridine-4-carboxamide is sourced from PubChem (CID 110862205), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).