N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide

C14H15N3O2 — CID 109223574

IUPACN-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C14H15N3O2/c18-14(17-11-3-4-11)10-6-12(8-15-7-10)16-9-13-2-1-5-19-13/h1-2,5-8,11,16H,3-4,9H2,(H,17,18)
InChIKeyKNOIUFNAXNIRGG-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.18
Rot. Bonds5

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

N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide (PubChem CID 109223574) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
PubChem CID109223574
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC NameN-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide
SMILESO=C(NC1CC1)c1cncc(NCc2ccco2)c1
InChIInChI=1S/C14H15N3O2/c18-14(17-11-3-4-11)10-6-12(8-15-7-10)16-9-13-2-1-5-19-13/h1-2,5-8,11,16H,3-4,9H2,(H,17,18)
InChIKeyKNOIUFNAXNIRGG-UHFFFAOYSA-N
XLogP2.18
TPSA67.16 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.18
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide (CID 109223574) is N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide is O=C(NC1CC1)c1cncc(NCc2ccco2)c1.
What is the InChIKey of N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
The InChIKey is KNOIUFNAXNIRGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c18-14(17-11-3-4-11)10-6-12(8-15-7-10)16-9-13-2-1-5-19-13/h1-2,5-8,11,16H,3-4,9H2,(H,17,18).
What are the key properties of N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide?
N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.18, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-5-(furan-2-ylmethylamino)pyridine-3-carboxamide is sourced from PubChem (CID 109223574), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).