N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide

C15H16N2O3 — CID 75417029

IUPACN-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCC(c1ccco1)N(C(=O)c1ccc(=O)[nH]c1)C1CC1
InChIInChI=1S/C15H16N2O3/c1-10(13-3-2-8-20-13)17(12-5-6-12)15(19)11-4-7-14(18)16-9-11/h2-4,7-10,12H,5-6H2,1H3,(H,16,18)
InChIKeyYGGZIHTXOOXZPH-UHFFFAOYSA-N
MW272.30 g/mol
LogP2.33
Rot. Bonds4

About N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide

N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide (PubChem CID 75417029) has the molecular formula C15H16N2O3 and a molecular weight of 272.30 g/mol. Its IUPAC name is N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide.

Molecular Properties

Compound NameN-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
PubChem CID75417029
Molecular FormulaC15H16N2O3
Molecular Weight272.30 g/mol
Exact Mass272.12
IUPAC NameN-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide
SMILESCC(c1ccco1)N(C(=O)c1ccc(=O)[nH]c1)C1CC1
InChIInChI=1S/C15H16N2O3/c1-10(13-3-2-8-20-13)17(12-5-6-12)15(19)11-4-7-14(18)16-9-11/h2-4,7-10,12H,5-6H2,1H3,(H,16,18)
InChIKeyYGGZIHTXOOXZPH-UHFFFAOYSA-N
XLogP2.33
TPSA66.31 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.30
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The IUPAC name of N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide (CID 75417029) is N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide.
What is the SMILES notation for N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The canonical SMILES for N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide is CC(c1ccco1)N(C(=O)c1ccc(=O)[nH]c1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
The InChIKey is YGGZIHTXOOXZPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H16N2O3/c1-10(13-3-2-8-20-13)17(12-5-6-12)15(19)11-4-7-14(18)16-9-11/h2-4,7-10,12H,5-6H2,1H3,(H,16,18).
What are the key properties of N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide?
N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide has a molecular weight of 272.30 g/mol, XLogP of 2.33, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-[1-(furan-2-yl)ethyl]-6-oxo-1H-pyridine-3-carboxamide is sourced from PubChem (CID 75417029), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).