6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide

C13H15N3O2 — CID 62523594

IUPAC6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCc2ccc(C)o2)cn1
InChIInChI=1S/C13H15N3O2/c1-9-3-5-11(18-9)8-16-13(17)10-4-6-12(14-2)15-7-10/h3-7H,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyKOFSCHCQRKVXFE-UHFFFAOYSA-N
MW245.28 g/mol
LogP1.95
Rot. Bonds4

About 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide

6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide (PubChem CID 62523594) has the molecular formula C13H15N3O2 and a molecular weight of 245.28 g/mol. Its IUPAC name is 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide.

Molecular Properties

Compound Name6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
PubChem CID62523594
Molecular FormulaC13H15N3O2
Molecular Weight245.28 g/mol
Exact Mass245.12
IUPAC Name6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide
SMILESCNc1ccc(C(=O)NCc2ccc(C)o2)cn1
InChIInChI=1S/C13H15N3O2/c1-9-3-5-11(18-9)8-16-13(17)10-4-6-12(14-2)15-7-10/h3-7H,8H2,1-2H3,(H,14,15)(H,16,17)
InChIKeyKOFSCHCQRKVXFE-UHFFFAOYSA-N
XLogP1.95
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.28
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(methylamino)-N-[(5-methylfuran-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 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The IUPAC name of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide (CID 62523594) is 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide.
What is the SMILES notation for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The canonical SMILES for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide is CNc1ccc(C(=O)NCc2ccc(C)o2)cn1.
What is the InChIKey of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
The InChIKey is KOFSCHCQRKVXFE-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O2/c1-9-3-5-11(18-9)8-16-13(17)10-4-6-12(14-2)15-7-10/h3-7H,8H2,1-2H3,(H,14,15)(H,16,17).
What are the key properties of 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide?
6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide has a molecular weight of 245.28 g/mol, XLogP of 1.95, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methylamino)-N-[(5-methylfuran-2-yl)methyl]pyridine-3-carboxamide is sourced from PubChem (CID 62523594), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).