6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide

C17H19N3O2 — CID 110862104

IUPAC6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(C(=O)Nc2ccc(N3CCCC3)cc2)n1
InChIInChI=1S/C17H19N3O2/c1-22-16-6-4-5-15(19-16)17(21)18-13-7-9-14(10-8-13)20-11-2-3-12-20/h4-10H,2-3,11-12H2,1H3,(H,18,21)
InChIKeyLTLJPVSFFYIVBW-UHFFFAOYSA-N
MW297.36 g/mol
LogP2.94
Rot. Bonds4

About 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide

6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide (PubChem CID 110862104) has the molecular formula C17H19N3O2 and a molecular weight of 297.36 g/mol. Its IUPAC name is 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
PubChem CID110862104
Molecular FormulaC17H19N3O2
Molecular Weight297.36 g/mol
Exact Mass297.15
IUPAC Name6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
SMILESCOc1cccc(C(=O)Nc2ccc(N3CCCC3)cc2)n1
InChIInChI=1S/C17H19N3O2/c1-22-16-6-4-5-15(19-16)17(21)18-13-7-9-14(10-8-13)20-11-2-3-12-20/h4-10H,2-3,11-12H2,1H3,(H,18,21)
InChIKeyLTLJPVSFFYIVBW-UHFFFAOYSA-N
XLogP2.94
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.36
LogP ≤ 52.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

Analyze 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

6-methyl-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide
CID 38697211
6-N-cyclohexyl-2-N-(4-pyrrolidin-1-ylphenyl)pyridine-2,6-dicarboxamide
CID 109095385
5-(azepan-1-yl)-N-(4-methoxyphenyl)pyridine-2-carboxamide
CID 109196895
N-(4-methoxyphenyl)-5-(4-pyrrolidin-1-ylanilino)pyridine-2-carboxamide
CID 109199887
N-[4-(4-methylpiperazin-1-yl)phenyl]-6-(pyrrolidine-1-carbonyl)pyridine-2-carboxamide
CID 109094899
N-(4-pyrrolidin-1-ylphenyl)pyridazine-3-carboxamide
CID 110862074
N-[4-(azepan-1-yl)phenyl]-2-methylpyrimidine-4-carboxamide
CID 55856932
2-methoxy-N-(4-pyrrolidin-1-ylphenyl)benzamide
CID 960710
2-(N-methylanilino)-N-(4-pyrrolidin-1-ylphenyl)pyrimidine-4-carboxamide
CID 109314243
N-[4-[(4-piperidin-1-ylphenyl)carbamoyl]phenyl]pyridine-2-carboxamide
CID 46489538
2-methyl-6-pyrrolidin-1-yl-N-(4-pyrrolidin-1-ylphenyl)pyrimidine-4-carboxamide
CID 109362838
N-(3-chloro-4-methoxyphenyl)-6-pyrrolidin-1-ylpyridine-2-carboxamide
CID 84573514

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide?
The IUPAC name of 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide (CID 110862104) is 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide.
What is the SMILES notation for 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide?
The canonical SMILES for 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide is COc1cccc(C(=O)Nc2ccc(N3CCCC3)cc2)n1.
What is the InChIKey of 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide?
The InChIKey is LTLJPVSFFYIVBW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H19N3O2/c1-22-16-6-4-5-15(19-16)17(21)18-13-7-9-14(10-8-13)20-11-2-3-12-20/h4-10H,2-3,11-12H2,1H3,(H,18,21).
What are the key properties of 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide?
6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide has a molecular weight of 297.36 g/mol, XLogP of 2.94, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-N-(4-pyrrolidin-1-ylphenyl)pyridine-2-carboxamide is sourced from PubChem (CID 110862104), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).