5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide

C12H19NO3 — CID 107299752

IUPAC5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCCCC(C)O)o1
InChIInChI=1S/C12H19NO3/c1-3-10-6-7-11(16-10)12(15)13-8-4-5-9(2)14/h6-7,9,14H,3-5,8H2,1-2H3,(H,13,15)
InChIKeyIXOVHRQMDYFAEU-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.73
Rot. Bonds6

About 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide

5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide (PubChem CID 107299752) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide.

Molecular Properties

Compound Name5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
PubChem CID107299752
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC Name5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide
SMILESCCc1ccc(C(=O)NCCCC(C)O)o1
InChIInChI=1S/C12H19NO3/c1-3-10-6-7-11(16-10)12(15)13-8-4-5-9(2)14/h6-7,9,14H,3-5,8H2,1-2H3,(H,13,15)
InChIKeyIXOVHRQMDYFAEU-UHFFFAOYSA-N
XLogP1.73
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.73
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide with MolForge

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

Launch Full Analysis

Related Compounds

5-ethyl-N-(3-iodopropyl)furan-2-carboxamide
CID 114504288
N-(4-hydroxypentyl)-5-(pyrazol-1-ylmethyl)furan-2-carboxamide
CID 107300126
N-(5-aminopentyl)-5-ethylfuran-2-carboxamide
CID 79094477
N-(2-cyanoethyl)-5-ethylfuran-2-carboxamide
CID 112726773
5-ethyl-N-(3-hydroxy-2-methylpropyl)furan-2-carboxamide
CID 65034203
N-(3-amino-2-hydroxy-3-oxopropyl)-5-ethylfuran-2-carboxamide
CID 106166165
N-(2-azidoethyl)-5-ethylfuran-2-carboxamide
CID 79084209
5-ethyl-N-methylfuran-2-carboxamide
CID 60751451
2-ethyl-N-(4-hydroxypentyl)benzamide
CID 107300304
5-ethyl-N-(2-hydroxy-2-phenylethyl)furan-2-carboxamide
CID 43427837
5-(aminomethyl)-N-(3-hydroxypentyl)furan-2-carboxamide
CID 115739064
5-ethyl-N-(3-imidazol-1-ylpropyl)furan-2-carboxamide
CID 47027033

Frequently Asked Questions

What is the IUPAC name of 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide?
The IUPAC name of 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide (CID 107299752) is 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide.
What is the SMILES notation for 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide?
The canonical SMILES for 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide is CCc1ccc(C(=O)NCCCC(C)O)o1.
What is the InChIKey of 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide?
The InChIKey is IXOVHRQMDYFAEU-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-3-10-6-7-11(16-10)12(15)13-8-4-5-9(2)14/h6-7,9,14H,3-5,8H2,1-2H3,(H,13,15).
What are the key properties of 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide?
5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide has a molecular weight of 225.29 g/mol, XLogP of 1.73, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-ethyl-N-(4-hydroxypentyl)furan-2-carboxamide is sourced from PubChem (CID 107299752), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).