5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

C13H14N2O2 — CID 32623665

IUPAC5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCc1ccc(C(=O)NCCc2ccccn2)o1
InChIInChI=1S/C13H14N2O2/c1-10-5-6-12(17-10)13(16)15-9-7-11-4-2-3-8-14-11/h2-6,8H,7,9H2,1H3,(H,15,16)
InChIKeyQZWLMURQTRXWHV-UHFFFAOYSA-N
MW230.27 g/mol
LogP1.96
Rot. Bonds4

About 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide

5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (PubChem CID 32623665) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
PubChem CID32623665
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide
SMILESCc1ccc(C(=O)NCCc2ccccn2)o1
InChIInChI=1S/C13H14N2O2/c1-10-5-6-12(17-10)13(16)15-9-7-11-4-2-3-8-14-11/h2-6,8H,7,9H2,1H3,(H,15,16)
InChIKeyQZWLMURQTRXWHV-UHFFFAOYSA-N
XLogP1.96
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The IUPAC name of 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide (CID 32623665) is 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide.
What is the SMILES notation for 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The canonical SMILES for 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is Cc1ccc(C(=O)NCCc2ccccn2)o1.
What is the InChIKey of 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
The InChIKey is QZWLMURQTRXWHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-10-5-6-12(17-10)13(16)15-9-7-11-4-2-3-8-14-11/h2-6,8H,7,9H2,1H3,(H,15,16).
What are the key properties of 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide?
5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 1.96, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(2-pyridin-2-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 32623665), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).