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

C15H18N2O3 — CID 37485352

IUPACN-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCOc1ncccc1CNC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C15H18N2O3/c1-9-10(2)20-11(3)13(9)14(18)17-8-12-6-5-7-16-15(12)19-4/h5-7H,8H2,1-4H3,(H,17,18)
InChIKeyVFEDLZIUSJCASL-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.54
Rot. Bonds4

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

N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 37485352) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
PubChem CID37485352
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC NameN-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide
SMILESCOc1ncccc1CNC(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C15H18N2O3/c1-9-10(2)20-11(3)13(9)14(18)17-8-12-6-5-7-16-15(12)19-4/h5-7H,8H2,1-4H3,(H,17,18)
InChIKeyVFEDLZIUSJCASL-UHFFFAOYSA-N
XLogP2.54
TPSA64.36 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.32
LogP ≤ 52.54
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2,5-dimethyl-N-(pyridin-4-yl)furan-3-carboxamide
CID 17248960
2-Methyl-furan-3-carboxylic acid pyridin-2-ylmethylene-hydrazide
CID 6871824
2-(pyridin-4-yl)-4H,5H,6H,7H-furo[3,2-c]pyridin-4-one
CID 24778303
2-(4-Pyridinyl)furo[3,2-C]pyridin-4(5h)-One
CID 53245729
2-ethoxy-N-[(2-fluorophenyl)methyl]pyridine-3-carboxamide
CID 2080643
2-ethoxy-N-(4-phenylbutan-2-yl)pyridine-3-carboxamide
CID 4794993
2-ethoxy-N-[2-(4-methoxyphenyl)ethyl]pyridine-3-carboxamide
CID 9113215
6-Methyl-3-(2-methylpropyl)-N-(5-methylpyridin-2-YL)-4-oxo-3H,4H-furo[2,3-D]pyrimidine-5-carboxamide
CID 16023780
(4-Fluoro-4-{[(5-methyl-pyridin-2-ylmethyl)-amino]-methyl}-piperidin-1-yl)-furan-3-yl-methanone
CID 42606461
2,5-dimethyl-N-[(E)-pyridin-4-ylmethylideneamino]furan-3-carboxamide
CID 5412707
2-methyl-N-(pyridin-3-yl)furan-3-carboxamide
CID 573291
2-methyl-N-(2-pyridinylmethyl)-3-furamide
CID 896600

Frequently Asked Questions

What is the IUPAC name of N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide (CID 37485352) is N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide is COc1ncccc1CNC(=O)c1c(C)oc(C)c1C.
What is the InChIKey of N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is VFEDLZIUSJCASL-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-9-10(2)20-11(3)13(9)14(18)17-8-12-6-5-7-16-15(12)19-4/h5-7H,8H2,1-4H3,(H,17,18).
What are the key properties of N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide?
N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 2.54, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-methoxy-3-pyridinyl)methyl]-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 37485352), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).