N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide

C14H23NO4 — CID 110003110

IUPACN-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide
SMILESCOCC(C)(CCO)NC(=O)CCc1ccc(C)o1
InChIInChI=1S/C14H23NO4/c1-11-4-5-12(19-11)6-7-13(17)15-14(2,8-9-16)10-18-3/h4-5,16H,6-10H2,1-3H3,(H,15,17)
InChIKeyQPWPUDNBRAPWNN-UHFFFAOYSA-N
MW269.34 g/mol
LogP1.42
Rot. Bonds8

About N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide

N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide (PubChem CID 110003110) has the molecular formula C14H23NO4 and a molecular weight of 269.34 g/mol. Its IUPAC name is N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound NameN-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide
PubChem CID110003110
Molecular FormulaC14H23NO4
Molecular Weight269.34 g/mol
Exact Mass269.16
IUPAC NameN-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide
SMILESCOCC(C)(CCO)NC(=O)CCc1ccc(C)o1
InChIInChI=1S/C14H23NO4/c1-11-4-5-12(19-11)6-7-13(17)15-14(2,8-9-16)10-18-3/h4-5,16H,6-10H2,1-3H3,(H,15,17)
InChIKeyQPWPUDNBRAPWNN-UHFFFAOYSA-N
XLogP1.42
TPSA71.70 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.34
LogP ≤ 51.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide 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

2-methyl-2-[3-(5-methylfuran-2-yl)propanoylamino]pentanoic acid
CID 84588870
3-(5-methylfuran-2-yl)-N-[3-[3-(5-methylfuran-2-yl)propanoylamino]propyl]propanamide
CID 4780000
(E)-N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-4-(4-methylphenyl)but-3-enamide
CID 110002888
1,11-bis(5-methylfuran-2-yl)undecane-3,6,9-trione
CID 71384501
3-methoxy-2-methyl-2-[(5-methylfuran-2-yl)methylamino]propanoic acid
CID 115002340
N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3,4-dimethylbenzamide
CID 110003023
N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-5-methylthiophene-2-carboxamide
CID 110003162
4-fluoro-N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)benzamide
CID 110002940
N-(4-ethoxyphenyl)-3-(5-methylfuran-2-yl)propanamide
CID 2243182
ethane;2-(5-methylfuran-2-yl)ethanol
CID 142104864
N-(4-methoxy-2-nitrophenyl)-3-(5-methylfuran-2-yl)propanamide
CID 16648625
N-[[(2S,3R)-2-tert-butyloxolan-3-yl]methyl]-3-(5-methylfuran-2-yl)propanamide
CID 129002323

Frequently Asked Questions

What is the IUPAC name of N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide?
The IUPAC name of N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide (CID 110003110) is N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide is COCC(C)(CCO)NC(=O)CCc1ccc(C)o1.
What is the InChIKey of N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide?
The InChIKey is QPWPUDNBRAPWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23NO4/c1-11-4-5-12(19-11)6-7-13(17)15-14(2,8-9-16)10-18-3/h4-5,16H,6-10H2,1-3H3,(H,15,17).
What are the key properties of N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide?
N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide has a molecular weight of 269.34 g/mol, XLogP of 1.42, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-hydroxy-1-methoxy-2-methylbutan-2-yl)-3-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 110003110), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).