N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide

C12H19NO5 — CID 78874120

IUPACN-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide
SMILESCOCCOCCNC(=O)c1ccc(COC)o1
InChIInChI=1S/C12H19NO5/c1-15-7-8-17-6-5-13-12(14)11-4-3-10(18-11)9-16-2/h3-4H,5-9H2,1-2H3,(H,13,14)
InChIKeyVLOOUWSJQQRHQT-UHFFFAOYSA-N
MW257.29 g/mol
LogP0.82
Rot. Bonds9

About N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide

N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide (PubChem CID 78874120) has the molecular formula C12H19NO5 and a molecular weight of 257.29 g/mol. Its IUPAC name is N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide
PubChem CID78874120
Molecular FormulaC12H19NO5
Molecular Weight257.29 g/mol
Exact Mass257.13
IUPAC NameN-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide
SMILESCOCCOCCNC(=O)c1ccc(COC)o1
InChIInChI=1S/C12H19NO5/c1-15-7-8-17-6-5-13-12(14)11-4-3-10(18-11)9-16-2/h3-4H,5-9H2,1-2H3,(H,13,14)
InChIKeyVLOOUWSJQQRHQT-UHFFFAOYSA-N
XLogP0.82
TPSA69.93 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds9
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.29
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)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-(methoxymethyl)-N-[2-(methylamino)ethyl]furan-2-carboxamide;hydrochloride
CID 119500596
N-[2-(ethylamino)ethyl]-5-(methoxymethyl)furan-2-carboxamide;hydrochloride
CID 119505332
5-(methoxymethyl)-N-(3-propan-2-yloxypropyl)furan-2-carboxamide
CID 78827233
5-(methoxymethyl)-N-[2-oxo-2-(propylamino)ethyl]furan-2-carboxamide
CID 78827647
5-(methoxymethyl)-N-(7-methyloctyl)furan-2-carboxamide
CID 78847305
5-[(3,5-dimethylphenoxy)methyl]-N-(2-methoxyethyl)furan-2-carboxamide
CID 19463380
N-(2-methoxyethyl)-5-[(4-propan-2-ylphenoxy)methyl]furan-2-carboxamide
CID 19448238
5-(methoxymethyl)-N-[2-[4-(trifluoromethoxy)phenyl]ethyl]furan-2-carboxamide
CID 78882053
5-(methoxymethyl)-N-[3-(N-methylanilino)propyl]furan-2-carboxamide
CID 78833523
5-(methoxymethyl)-N-[(4-methylsulfonylphenyl)methyl]furan-2-carboxamide
CID 78872860
methyl N-[4-[[[5-(methoxymethyl)furan-2-carbonyl]amino]methyl]phenyl]carbamate
CID 78902905
5-(methoxymethyl)-N-[(2,4,6-trimethylphenyl)methyl]furan-2-carboxamide
CID 78851950

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The IUPAC name of N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide (CID 78874120) is N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide.
What is the SMILES notation for N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The canonical SMILES for N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide is COCCOCCNC(=O)c1ccc(COC)o1.
What is the InChIKey of N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
The InChIKey is VLOOUWSJQQRHQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO5/c1-15-7-8-17-6-5-13-12(14)11-4-3-10(18-11)9-16-2/h3-4H,5-9H2,1-2H3,(H,13,14).
What are the key properties of N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide?
N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide has a molecular weight of 257.29 g/mol, XLogP of 0.82, 9 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methoxyethoxy)ethyl]-5-(methoxymethyl)furan-2-carboxamide is sourced from PubChem (CID 78874120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).