N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide

C16H13N3O2 — CID 121018130

IUPACN-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide
SMILESO=C(NCc1ccnc(-c2ccncc2)c1)c1ccoc1
InChIInChI=1S/C16H13N3O2/c20-16(14-4-8-21-11-14)19-10-12-1-7-18-15(9-12)13-2-5-17-6-3-13/h1-9,11H,10H2,(H,19,20)
InChIKeyZSTSAEZWRQKEFT-UHFFFAOYSA-N
MW279.30 g/mol
LogP2.67
Rot. Bonds4

About N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide

N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide (PubChem CID 121018130) has the molecular formula C16H13N3O2 and a molecular weight of 279.30 g/mol. Its IUPAC name is N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide.

Molecular Properties

Compound NameN-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide
PubChem CID121018130
Molecular FormulaC16H13N3O2
Molecular Weight279.30 g/mol
Exact Mass279.10
IUPAC NameN-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide
SMILESO=C(NCc1ccnc(-c2ccncc2)c1)c1ccoc1
InChIInChI=1S/C16H13N3O2/c20-16(14-4-8-21-11-14)19-10-12-1-7-18-15(9-12)13-2-5-17-6-3-13/h1-9,11H,10H2,(H,19,20)
InChIKeyZSTSAEZWRQKEFT-UHFFFAOYSA-N
XLogP2.67
TPSA68.02 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.30
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-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

3,4-difluoro-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]benzamide
CID 121165286
4-(2-methoxyethoxy)-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]benzamide
CID 121165392
3-pyrazol-1-yl-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]benzamide
CID 121018137
N-[(2-pyridin-4-yl-4-pyridinyl)methyl]-2-pyrrol-1-ylacetamide
CID 119100867
2,4-dimethyl-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]benzamide
CID 121165448
3-phenyl-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]-1H-pyrazole-5-carboxamide
CID 121165402
N-[(2-phenylmethoxy-4-pyridinyl)methyl]furan-3-carboxamide
CID 46475605
methyl 2-[(2-pyridin-4-yl-4-pyridinyl)methylcarbamoyl]benzoate
CID 121165433
3-[(furan-3-carbonylamino)methyl]benzoic acid
CID 60894235
N-[(2-pyridin-4-yl-4-pyridinyl)methyl]quinoline-2-carboxamide
CID 121165463
2-ethyl-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]-1,3-benzothiazole-6-carboxamide
CID 121165391
2-oxo-N-[(2-pyridin-4-yl-4-pyridinyl)methyl]chromene-3-carboxamide
CID 121165322

Frequently Asked Questions

What is the IUPAC name of N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide?
The IUPAC name of N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide (CID 121018130) is N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide.
What is the SMILES notation for N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide?
The canonical SMILES for N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide is O=C(NCc1ccnc(-c2ccncc2)c1)c1ccoc1.
What is the InChIKey of N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide?
The InChIKey is ZSTSAEZWRQKEFT-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3O2/c20-16(14-4-8-21-11-14)19-10-12-1-7-18-15(9-12)13-2-5-17-6-3-13/h1-9,11H,10H2,(H,19,20).
What are the key properties of N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide?
N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide has a molecular weight of 279.30 g/mol, XLogP of 2.67, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-pyridin-4-yl-4-pyridinyl)methyl]furan-3-carboxamide is sourced from PubChem (CID 121018130), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).