4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide

C14H16N2O3 — CID 91778944

IUPAC4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NCCc2ccc(C)o2)c1
InChIInChI=1S/C14H16N2O3/c1-10-3-4-11(19-10)5-8-16-14(17)13-9-12(18-2)6-7-15-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,16,17)
InChIKeyBDXSLJYAHBKEPB-UHFFFAOYSA-N
MW260.29 g/mol
LogP1.96
Rot. Bonds5

About 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide

4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide (PubChem CID 91778944) has the molecular formula C14H16N2O3 and a molecular weight of 260.29 g/mol. Its IUPAC name is 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide.

Molecular Properties

Compound Name4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
PubChem CID91778944
Molecular FormulaC14H16N2O3
Molecular Weight260.29 g/mol
Exact Mass260.12
IUPAC Name4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide
SMILESCOc1ccnc(C(=O)NCCc2ccc(C)o2)c1
InChIInChI=1S/C14H16N2O3/c1-10-3-4-11(19-10)5-8-16-14(17)13-9-12(18-2)6-7-15-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,16,17)
InChIKeyBDXSLJYAHBKEPB-UHFFFAOYSA-N
XLogP1.96
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.29
LogP ≤ 51.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The IUPAC name of 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide (CID 91778944) is 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide.
What is the SMILES notation for 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The canonical SMILES for 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide is COc1ccnc(C(=O)NCCc2ccc(C)o2)c1.
What is the InChIKey of 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
The InChIKey is BDXSLJYAHBKEPB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H16N2O3/c1-10-3-4-11(19-10)5-8-16-14(17)13-9-12(18-2)6-7-15-13/h3-4,6-7,9H,5,8H2,1-2H3,(H,16,17).
What are the key properties of 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide?
4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide has a molecular weight of 260.29 g/mol, XLogP of 1.96, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methoxy-N-[2-(5-methylfuran-2-yl)ethyl]pyridine-2-carboxamide is sourced from PubChem (CID 91778944), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).