N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide

C16H14N4O2 — CID 113027750

IUPACN-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NCc2cccnc2)cn1)c1ccco1
InChIInChI=1S/C16H14N4O2/c21-16(14-4-2-8-22-14)20-15-6-5-13(11-19-15)18-10-12-3-1-7-17-9-12/h1-9,11,18H,10H2,(H,19,20,21)
InChIKeyOSFZUWWSUPWOFD-UHFFFAOYSA-N
MW294.31 g/mol
LogP2.93
Rot. Bonds5

About N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide

N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide (PubChem CID 113027750) has the molecular formula C16H14N4O2 and a molecular weight of 294.31 g/mol. Its IUPAC name is N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
PubChem CID113027750
Molecular FormulaC16H14N4O2
Molecular Weight294.31 g/mol
Exact Mass294.11
IUPAC NameN-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide
SMILESO=C(Nc1ccc(NCc2cccnc2)cn1)c1ccco1
InChIInChI=1S/C16H14N4O2/c21-16(14-4-2-8-22-14)20-15-6-5-13(11-19-15)18-10-12-3-1-7-17-9-12/h1-9,11,18H,10H2,(H,19,20,21)
InChIKeyOSFZUWWSUPWOFD-UHFFFAOYSA-N
XLogP2.93
TPSA80.05 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.31
LogP ≤ 52.93
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]thiophene-2-carboxamide
CID 113027751
1-phenyl-3-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]urea
CID 113027801
N-[6-[(4-chlorophenyl)methylamino]-3-pyridinyl]furan-2-carboxamide
CID 113012273
N-[5-[(2-methoxyphenyl)methylamino]-2-pyridinyl]furan-2-carboxamide
CID 113027322
N-[5-(3-phenylpropylamino)-2-pyridinyl]furan-2-carboxamide
CID 113029807
N-[5-[2-(4-fluorophenyl)ethylamino]-2-pyridinyl]furan-2-carboxamide
CID 113028255
N-[5-(propan-2-ylamino)-2-pyridinyl]furan-2-carboxamide
CID 113023557
N-[4-[(2-pyridin-3-ylacetyl)amino]phenyl]furan-2-carboxamide
CID 17297144
2-chloro-6-fluoro-N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]benzamide
CID 113027789
N-[5-(butanoylamino)-2-pyridinyl]furan-2-carboxamide
CID 1452808
N-[5-(4-phenoxyanilino)-2-pyridinyl]furan-2-carboxamide
CID 113035819
N-[5-(2-ethylanilino)-2-pyridinyl]furan-2-carboxamide
CID 113032400

Frequently Asked Questions

What is the IUPAC name of N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide?
The IUPAC name of N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide (CID 113027750) is N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide.
What is the SMILES notation for N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide?
The canonical SMILES for N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide is O=C(Nc1ccc(NCc2cccnc2)cn1)c1ccco1.
What is the InChIKey of N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide?
The InChIKey is OSFZUWWSUPWOFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H14N4O2/c21-16(14-4-2-8-22-14)20-15-6-5-13(11-19-15)18-10-12-3-1-7-17-9-12/h1-9,11,18H,10H2,(H,19,20,21).
What are the key properties of N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide?
N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide has a molecular weight of 294.31 g/mol, XLogP of 2.93, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[5-(pyridin-3-ylmethylamino)-2-pyridinyl]furan-2-carboxamide is sourced from PubChem (CID 113027750), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).