5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide

C14H15N3O2 — CID 81317098

IUPAC5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)N(Cc2ccco2)C2CC2)nc1
InChIInChI=1S/C14H15N3O2/c15-10-3-6-13(16-8-10)14(18)17(11-4-5-11)9-12-2-1-7-19-12/h1-3,6-8,11H,4-5,9,15H2
InChIKeyDZERMNGEOCMTFJ-UHFFFAOYSA-N
MW257.29 g/mol
LogP2.06
Rot. Bonds4

About 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide

5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide (PubChem CID 81317098) has the molecular formula C14H15N3O2 and a molecular weight of 257.29 g/mol. Its IUPAC name is 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide.

Molecular Properties

Compound Name5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide
PubChem CID81317098
Molecular FormulaC14H15N3O2
Molecular Weight257.29 g/mol
Exact Mass257.12
IUPAC Name5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide
SMILESNc1ccc(C(=O)N(Cc2ccco2)C2CC2)nc1
InChIInChI=1S/C14H15N3O2/c15-10-3-6-13(16-8-10)14(18)17(11-4-5-11)9-12-2-1-7-19-12/h1-3,6-8,11H,4-5,9,15H2
InChIKeyDZERMNGEOCMTFJ-UHFFFAOYSA-N
XLogP2.06
TPSA72.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 52.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The IUPAC name of 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide (CID 81317098) is 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide.
What is the SMILES notation for 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The canonical SMILES for 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide is Nc1ccc(C(=O)N(Cc2ccco2)C2CC2)nc1.
What is the InChIKey of 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
The InChIKey is DZERMNGEOCMTFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15N3O2/c15-10-3-6-13(16-8-10)14(18)17(11-4-5-11)9-12-2-1-7-19-12/h1-3,6-8,11H,4-5,9,15H2.
What are the key properties of 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide?
5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 2.06, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-amino-N-cyclopropyl-N-(furan-2-ylmethyl)pyridine-2-carboxamide is sourced from PubChem (CID 81317098), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).