5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide

C15H16N4O4 — CID 175964659

IUPAC5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(N2CCC(O)C2)c(NC(=O)c2ccco2)c1
InChIInChI=1S/C15H16N4O4/c16-13(21)9-6-11(18-15(22)12-2-1-5-23-12)14(17-7-9)19-4-3-10(20)8-19/h1-2,5-7,10,20H,3-4,8H2,(H2,16,21)(H,18,22)
InChIKeyYQCRUTLVDRFIQE-UHFFFAOYSA-N
MW316.32 g/mol
LogP0.60
Rot. Bonds4

About 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide

5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide (PubChem CID 175964659) has the molecular formula C15H16N4O4 and a molecular weight of 316.32 g/mol. Its IUPAC name is 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide.

Molecular Properties

Compound Name5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide
PubChem CID175964659
Molecular FormulaC15H16N4O4
Molecular Weight316.32 g/mol
Exact Mass316.12
IUPAC Name5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide
SMILESNC(=O)c1cnc(N2CCC(O)C2)c(NC(=O)c2ccco2)c1
InChIInChI=1S/C15H16N4O4/c16-13(21)9-6-11(18-15(22)12-2-1-5-23-12)14(17-7-9)19-4-3-10(20)8-19/h1-2,5-7,10,20H,3-4,8H2,(H2,16,21)(H,18,22)
InChIKeyYQCRUTLVDRFIQE-UHFFFAOYSA-N
XLogP0.60
TPSA121.69 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500316.32
LogP ≤ 50.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide?
The IUPAC name of 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide (CID 175964659) is 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide.
What is the SMILES notation for 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide?
The canonical SMILES for 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide is NC(=O)c1cnc(N2CCC(O)C2)c(NC(=O)c2ccco2)c1.
What is the InChIKey of 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide?
The InChIKey is YQCRUTLVDRFIQE-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N4O4/c16-13(21)9-6-11(18-15(22)12-2-1-5-23-12)14(17-7-9)19-4-3-10(20)8-19/h1-2,5-7,10,20H,3-4,8H2,(H2,16,21)(H,18,22).
What are the key properties of 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide?
5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide has a molecular weight of 316.32 g/mol, XLogP of 0.60, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(furan-2-carbonylamino)-6-(3-hydroxypyrrolidin-1-yl)pyridine-3-carboxamide is sourced from PubChem (CID 175964659), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).