N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide

C14H20N2O3 — CID 4690796

IUPACN-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide
SMILESO=C(CNC(=O)C1CCCCC1)NCc1ccco1
InChIInChI=1S/C14H20N2O3/c17-13(15-9-12-7-4-8-19-12)10-16-14(18)11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,15,17)(H,16,18)
InChIKeyGTKOKIFQASMGFW-UHFFFAOYSA-N
MW264.32 g/mol
LogP1.59
Rot. Bonds5

About N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide

N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide (PubChem CID 4690796) has the molecular formula C14H20N2O3 and a molecular weight of 264.32 g/mol. Its IUPAC name is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide.

Molecular Properties

Compound NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide
PubChem CID4690796
Molecular FormulaC14H20N2O3
Molecular Weight264.32 g/mol
Exact Mass264.15
IUPAC NameN-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide
SMILESO=C(CNC(=O)C1CCCCC1)NCc1ccco1
InChIInChI=1S/C14H20N2O3/c17-13(15-9-12-7-4-8-19-12)10-16-14(18)11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,15,17)(H,16,18)
InChIKeyGTKOKIFQASMGFW-UHFFFAOYSA-N
XLogP1.59
TPSA71.34 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.32
LogP ≤ 51.59
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Analyze N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide?
The IUPAC name of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide (CID 4690796) is N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide.
What is the SMILES notation for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide?
The canonical SMILES for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide is O=C(CNC(=O)C1CCCCC1)NCc1ccco1.
What is the InChIKey of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide?
The InChIKey is GTKOKIFQASMGFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N2O3/c17-13(15-9-12-7-4-8-19-12)10-16-14(18)11-5-2-1-3-6-11/h4,7-8,11H,1-3,5-6,9-10H2,(H,15,17)(H,16,18).
What are the key properties of N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide?
N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide has a molecular weight of 264.32 g/mol, XLogP of 1.59, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(furan-2-ylmethylamino)-2-oxoethyl]cyclohexanecarboxamide is sourced from PubChem (CID 4690796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).