N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide

C16H20N2O3 — CID 37487154

IUPACN-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCCOc1ncccc1CNC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C16H20N2O3/c1-5-20-16-13(7-6-8-17-16)9-18-15(19)14-10(2)11(3)21-12(14)4/h6-8H,5,9H2,1-4H3,(H,18,19)
InChIKeyWXRAQGAVEIIHNX-UHFFFAOYSA-N
MW288.35 g/mol
LogP2.93
Rot. Bonds5

About N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide

N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 37487154) has the molecular formula C16H20N2O3 and a molecular weight of 288.35 g/mol. Its IUPAC name is N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
PubChem CID37487154
Molecular FormulaC16H20N2O3
Molecular Weight288.35 g/mol
Exact Mass288.15
IUPAC NameN-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCCOc1ncccc1CNC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C16H20N2O3/c1-5-20-16-13(7-6-8-17-16)9-18-15(19)14-10(2)11(3)21-12(14)4/h6-8H,5,9H2,1-4H3,(H,18,19)
InChIKeyWXRAQGAVEIIHNX-UHFFFAOYSA-N
XLogP2.93
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 52.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide (CID 37487154) is N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide is CCOc1ncccc1CNC(=O)c1c(C)oc(C)c1C.
What is the InChIKey of N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is WXRAQGAVEIIHNX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O3/c1-5-20-16-13(7-6-8-17-16)9-18-15(19)14-10(2)11(3)21-12(14)4/h6-8H,5,9H2,1-4H3,(H,18,19).
What are the key properties of N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 288.35 g/mol, XLogP of 2.93, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-ethoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 37487154), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).