2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide

C15H18N2O3 — CID 90649337

IUPAC2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide
SMILESCc1cc(C(=O)NCC(C)Oc2cccnc2)c(C)o1
InChIInChI=1S/C15H18N2O3/c1-10-7-14(12(3)19-10)15(18)17-8-11(2)20-13-5-4-6-16-9-13/h4-7,9,11H,8H2,1-3H3,(H,17,18)
InChIKeyHXZRNRPMLVAWNZ-UHFFFAOYSA-N
MW274.32 g/mol
LogP2.49
Rot. Bonds5

About 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide

2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide (PubChem CID 90649337) has the molecular formula C15H18N2O3 and a molecular weight of 274.32 g/mol. Its IUPAC name is 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide.

Molecular Properties

Compound Name2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide
PubChem CID90649337
Molecular FormulaC15H18N2O3
Molecular Weight274.32 g/mol
Exact Mass274.13
IUPAC Name2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide
SMILESCc1cc(C(=O)NCC(C)Oc2cccnc2)c(C)o1
InChIInChI=1S/C15H18N2O3/c1-10-7-14(12(3)19-10)15(18)17-8-11(2)20-13-5-4-6-16-9-13/h4-7,9,11H,8H2,1-3H3,(H,17,18)
InChIKeyHXZRNRPMLVAWNZ-UHFFFAOYSA-N
XLogP2.49
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 ≤ 52.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide?
The IUPAC name of 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide (CID 90649337) is 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide.
What is the SMILES notation for 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide?
The canonical SMILES for 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide is Cc1cc(C(=O)NCC(C)Oc2cccnc2)c(C)o1.
What is the InChIKey of 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide?
The InChIKey is HXZRNRPMLVAWNZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O3/c1-10-7-14(12(3)19-10)15(18)17-8-11(2)20-13-5-4-6-16-9-13/h4-7,9,11H,8H2,1-3H3,(H,17,18).
What are the key properties of 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide?
2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide has a molecular weight of 274.32 g/mol, XLogP of 2.49, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2,5-dimethyl-N-(2-pyridin-3-yloxypropyl)furan-3-carboxamide is sourced from PubChem (CID 90649337), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).