5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide

C15H18N2O3 — CID 91790024

IUPAC5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide
SMILESCOc1ccc(C(=O)NC(c2ccccn2)C(C)C)o1
InChIInChI=1S/C15H18N2O3/c1-10(2)14(11-6-4-5-9-16-11)17-15(18)12-7-8-13(19-3)20-12/h4-10,14H,1-3H3,(H,17,18)
InChIKeyKSRUWQIKILFCBP-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.81
Rot. Bonds5

About 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide

5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide (PubChem CID 91790024) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide
PubChem CID91790024
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide
SMILESCOc1ccc(C(=O)NC(c2ccccn2)C(C)C)o1
InChIInChI=1S/C15H18N2O3/c1-10(2)14(11-6-4-5-9-16-11)17-15(18)12-7-8-13(19-3)20-12/h4-10,14H,1-3H3,(H,17,18)
InChIKeyKSRUWQIKILFCBP-UHFFFAOYSA-N
XLogP2.81
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide?
The IUPAC name of 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide (CID 91790024) is 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide.
What is the SMILES notation for 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide?
The canonical SMILES for 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide is COc1ccc(C(=O)NC(c2ccccn2)C(C)C)o1.
What is the InChIKey of 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide?
The InChIKey is KSRUWQIKILFCBP-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10(2)14(11-6-4-5-9-16-11)17-15(18)12-7-8-13(19-3)20-12/h4-10,14H,1-3H3,(H,17,18).
What are the key properties of 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide?
5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 2.81, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-N-(2-methyl-1-pyridin-2-ylpropyl)furan-2-carboxamide is sourced from PubChem (CID 91790024), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).