2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide

C18H17N3O2 — CID 23130667

IUPAC2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)NCc1ccc(Cc2ccccc2)o1
InChIInChI=1S/C18H17N3O2/c19-17-16(7-4-10-20-17)18(22)21-12-15-9-8-14(23-15)11-13-5-2-1-3-6-13/h1-10H,11-12H2,(H2,19,20)(H,21,22)
InChIKeyPMUBTACDLNWFFY-UHFFFAOYSA-N
MW307.35 g/mol
LogP2.78
Rot. Bonds5

About 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide

2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 23130667) has the molecular formula C18H17N3O2 and a molecular weight of 307.35 g/mol. Its IUPAC name is 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide
PubChem CID23130667
Molecular FormulaC18H17N3O2
Molecular Weight307.35 g/mol
Exact Mass307.13
IUPAC Name2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESNc1ncccc1C(=O)NCc1ccc(Cc2ccccc2)o1
InChIInChI=1S/C18H17N3O2/c19-17-16(7-4-10-20-17)18(22)21-12-15-9-8-14(23-15)11-13-5-2-1-3-6-13/h1-10H,11-12H2,(H2,19,20)(H,21,22)
InChIKeyPMUBTACDLNWFFY-UHFFFAOYSA-N
XLogP2.78
TPSA81.15 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 52.78
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide (CID 23130667) is 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide is Nc1ncccc1C(=O)NCc1ccc(Cc2ccccc2)o1.
What is the InChIKey of 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is PMUBTACDLNWFFY-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N3O2/c19-17-16(7-4-10-20-17)18(22)21-12-15-9-8-14(23-15)11-13-5-2-1-3-6-13/h1-10H,11-12H2,(H2,19,20)(H,21,22).
What are the key properties of 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide?
2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 307.35 g/mol, XLogP of 2.78, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[(5-benzylfuran-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 23130667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).