5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

C20H21N3O2 — CID 109231540

IUPAC5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCC(C)c1ccccc1NC(=O)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C20H21N3O2/c1-14(2)18-7-3-4-8-19(18)23-20(24)15-10-16(12-21-11-15)22-13-17-6-5-9-25-17/h3-12,14,22H,13H2,1-2H3,(H,23,24)
InChIKeyXJXWUGLTFLLSKZ-UHFFFAOYSA-N
MW335.41 g/mol
LogP4.66
Rot. Bonds6

About 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide

5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (PubChem CID 109231540) has the molecular formula C20H21N3O2 and a molecular weight of 335.41 g/mol. Its IUPAC name is 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
PubChem CID109231540
Molecular FormulaC20H21N3O2
Molecular Weight335.41 g/mol
Exact Mass335.16
IUPAC Name5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
SMILESCC(C)c1ccccc1NC(=O)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C20H21N3O2/c1-14(2)18-7-3-4-8-19(18)23-20(24)15-10-16(12-21-11-15)22-13-17-6-5-9-25-17/h3-12,14,22H,13H2,1-2H3,(H,23,24)
InChIKeyXJXWUGLTFLLSKZ-UHFFFAOYSA-N
XLogP4.66
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.41
LogP ≤ 54.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)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

Related Compounds

N-(2-ethylphenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231536
5-(furan-2-ylmethylamino)-N-(2-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231568
N-(2-cyanophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231622
5-(furan-2-ylmethylamino)-N-[2-(trifluoromethyl)phenyl]pyridine-3-carboxamide
CID 109231573
5-[(2-methylphenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109232147
5-[(4-chlorophenyl)methylamino]-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide
CID 109234113
5-(furan-2-ylmethylamino)-N-(4-propan-2-yloxyphenyl)pyridine-3-carboxamide
CID 109231569
N-(2,4-difluorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231606
N-(3,5-dichlorophenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231615
N-(4-chloro-2,5-dimethoxyphenyl)-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231618
N-[4-(diethylamino)phenyl]-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
CID 109231586
5-(furan-2-ylmethylamino)-N-propylpyridine-3-carboxamide
CID 109222782

Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The IUPAC name of 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide (CID 109231540) is 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The canonical SMILES for 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is CC(C)c1ccccc1NC(=O)c1cncc(NCc2ccco2)c1.
What is the InChIKey of 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
The InChIKey is XJXWUGLTFLLSKZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H21N3O2/c1-14(2)18-7-3-4-8-19(18)23-20(24)15-10-16(12-21-11-15)22-13-17-6-5-9-25-17/h3-12,14,22H,13H2,1-2H3,(H,23,24).
What are the key properties of 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide?
5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide has a molecular weight of 335.41 g/mol, XLogP of 4.66, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-ylmethylamino)-N-(2-propan-2-ylphenyl)pyridine-3-carboxamide is sourced from PubChem (CID 109231540), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).