2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide

C13H14N2O2 — CID 25344560

IUPAC2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2C)c(C)o1
InChIInChI=1S/C13H14N2O2/c1-8-5-4-6-14-12(8)15-13(16)11-7-9(2)17-10(11)3/h4-7H,1-3H3,(H,14,15,16)
InChIKeyHJJMOMBWBHVVGR-UHFFFAOYSA-N
MW230.27 g/mol
LogP2.85
Rot. Bonds2

About 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide

2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide (PubChem CID 25344560) has the molecular formula C13H14N2O2 and a molecular weight of 230.27 g/mol. Its IUPAC name is 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide
PubChem CID25344560
Molecular FormulaC13H14N2O2
Molecular Weight230.27 g/mol
Exact Mass230.11
IUPAC Name2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide
SMILESCc1cc(C(=O)Nc2ncccc2C)c(C)o1
InChIInChI=1S/C13H14N2O2/c1-8-5-4-6-14-12(8)15-13(16)11-7-9(2)17-10(11)3/h4-7H,1-3H3,(H,14,15,16)
InChIKeyHJJMOMBWBHVVGR-UHFFFAOYSA-N
XLogP2.85
TPSA55.13 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500230.27
LogP ≤ 52.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide (CID 25344560) is 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide is Cc1cc(C(=O)Nc2ncccc2C)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide?
The InChIKey is HJJMOMBWBHVVGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H14N2O2/c1-8-5-4-6-14-12(8)15-13(16)11-7-9(2)17-10(11)3/h4-7H,1-3H3,(H,14,15,16).
What are the key properties of 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide?
2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide has a molecular weight of 230.27 g/mol, XLogP of 2.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(3-methyl-2-pyridinyl)furan-3-carboxamide is sourced from PubChem (CID 25344560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).