N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide

C15H26N2O2 — CID 14423358

IUPACN-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide
SMILESCNCCCCCCCCN(C)C(=O)c1ccco1
InChIInChI=1S/C15H26N2O2/c1-16-11-7-5-3-4-6-8-12-17(2)15(18)14-10-9-13-19-14/h9-10,13,16H,3-8,11-12H2,1-2H3
InChIKeyJRQRZWZZKSQYJG-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.91
Rot. Bonds10

About N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide

N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide (PubChem CID 14423358) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide.

Molecular Properties

Compound NameN-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide
PubChem CID14423358
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC NameN-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide
SMILESCNCCCCCCCCN(C)C(=O)c1ccco1
InChIInChI=1S/C15H26N2O2/c1-16-11-7-5-3-4-6-8-12-17(2)15(18)14-10-9-13-19-14/h9-10,13,16H,3-8,11-12H2,1-2H3
InChIKeyJRQRZWZZKSQYJG-UHFFFAOYSA-N
XLogP2.91
TPSA45.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide?
The IUPAC name of N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide (CID 14423358) is N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide.
What is the SMILES notation for N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide?
The canonical SMILES for N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide is CNCCCCCCCCN(C)C(=O)c1ccco1.
What is the InChIKey of N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide?
The InChIKey is JRQRZWZZKSQYJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-16-11-7-5-3-4-6-8-12-17(2)15(18)14-10-9-13-19-14/h9-10,13,16H,3-8,11-12H2,1-2H3.
What are the key properties of N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide?
N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide has a molecular weight of 266.38 g/mol, XLogP of 2.91, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[8-(methylamino)octyl]furan-2-carboxamide is sourced from PubChem (CID 14423358), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).