2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide

C19H14N4O2 — CID 71061184

IUPAC2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide
SMILESNc1ncc(-c2coc3ccccc23)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C19H14N4O2/c20-18-15(19(24)23-13-5-7-21-8-6-13)9-12(10-22-18)16-11-25-17-4-2-1-3-14(16)17/h1-11H,(H2,20,22)(H,21,23,24)
InChIKeyQDJHWYVWXZCCGP-UHFFFAOYSA-N
MW330.35 g/mol
LogP3.72
Rot. Bonds3

About 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide

2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide (PubChem CID 71061184) has the molecular formula C19H14N4O2 and a molecular weight of 330.35 g/mol. Its IUPAC name is 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide.

Molecular Properties

Compound Name2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide
PubChem CID71061184
Molecular FormulaC19H14N4O2
Molecular Weight330.35 g/mol
Exact Mass330.11
IUPAC Name2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide
SMILESNc1ncc(-c2coc3ccccc23)cc1C(=O)Nc1ccncc1
InChIInChI=1S/C19H14N4O2/c20-18-15(19(24)23-13-5-7-21-8-6-13)9-12(10-22-18)16-11-25-17-4-2-1-3-14(16)17/h1-11H,(H2,20,22)(H,21,23,24)
InChIKeyQDJHWYVWXZCCGP-UHFFFAOYSA-N
XLogP3.72
TPSA94.04 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500330.35
LogP ≤ 53.72
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide?
The IUPAC name of 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide (CID 71061184) is 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide.
What is the SMILES notation for 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide?
The canonical SMILES for 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide is Nc1ncc(-c2coc3ccccc23)cc1C(=O)Nc1ccncc1.
What is the InChIKey of 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide?
The InChIKey is QDJHWYVWXZCCGP-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H14N4O2/c20-18-15(19(24)23-13-5-7-21-8-6-13)9-12(10-22-18)16-11-25-17-4-2-1-3-14(16)17/h1-11H,(H2,20,22)(H,21,23,24).
What are the key properties of 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide?
2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide has a molecular weight of 330.35 g/mol, XLogP of 3.72, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-5-(1-benzofuran-3-yl)-N-pyridin-4-ylpyridine-3-carboxamide is sourced from PubChem (CID 71061184), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).