N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide

C13H19NO3 — CID 21496541

IUPACN-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide
SMILESCON(C(=O)c1c(C)coc1C)C1CCCC1
InChIInChI=1S/C13H19NO3/c1-9-8-17-10(2)12(9)13(15)14(16-3)11-6-4-5-7-11/h8,11H,4-7H2,1-3H3
InChIKeyUHPOKUBAKWSJMV-UHFFFAOYSA-N
MW237.30 g/mol
LogP2.84
Rot. Bonds3

About N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide

N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide (PubChem CID 21496541) has the molecular formula C13H19NO3 and a molecular weight of 237.30 g/mol. Its IUPAC name is N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide
PubChem CID21496541
Molecular FormulaC13H19NO3
Molecular Weight237.30 g/mol
Exact Mass237.14
IUPAC NameN-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide
SMILESCON(C(=O)c1c(C)coc1C)C1CCCC1
InChIInChI=1S/C13H19NO3/c1-9-8-17-10(2)12(9)13(15)14(16-3)11-6-4-5-7-11/h8,11H,4-7H2,1-3H3
InChIKeyUHPOKUBAKWSJMV-UHFFFAOYSA-N
XLogP2.84
TPSA42.68 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.30
LogP ≤ 52.84
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide?
The IUPAC name of N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide (CID 21496541) is N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide?
The canonical SMILES for N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide is CON(C(=O)c1c(C)coc1C)C1CCCC1.
What is the InChIKey of N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide?
The InChIKey is UHPOKUBAKWSJMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19NO3/c1-9-8-17-10(2)12(9)13(15)14(16-3)11-6-4-5-7-11/h8,11H,4-7H2,1-3H3.
What are the key properties of N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide?
N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide has a molecular weight of 237.30 g/mol, XLogP of 2.84, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-N-methoxy-2,4-dimethylfuran-3-carboxamide is sourced from PubChem (CID 21496541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).