3-hydroxy-N-(5-methylfuran-2-yl)propanamide

C8H11NO3 — CID 115138791

IUPAC3-hydroxy-N-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(NC(=O)CCO)o1
InChIInChI=1S/C8H11NO3/c1-6-2-3-8(12-6)9-7(11)4-5-10/h2-3,10H,4-5H2,1H3,(H,9,11)
InChIKeyJGEJHAHFSHTDHA-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.91
Rot. Bonds3

About 3-hydroxy-N-(5-methylfuran-2-yl)propanamide

3-hydroxy-N-(5-methylfuran-2-yl)propanamide (PubChem CID 115138791) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is 3-hydroxy-N-(5-methylfuran-2-yl)propanamide.

Molecular Properties

Compound Name3-hydroxy-N-(5-methylfuran-2-yl)propanamide
PubChem CID115138791
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC Name3-hydroxy-N-(5-methylfuran-2-yl)propanamide
SMILESCc1ccc(NC(=O)CCO)o1
InChIInChI=1S/C8H11NO3/c1-6-2-3-8(12-6)9-7(11)4-5-10/h2-3,10H,4-5H2,1H3,(H,9,11)
InChIKeyJGEJHAHFSHTDHA-UHFFFAOYSA-N
XLogP0.91
TPSA62.47 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-amino-N-(5-methylfuran-2-yl)propanamide
CID 115152249
3-amino-2,2-dimethyl-N-(5-methylfuran-2-yl)propanamide
CID 115154533
N-(2,6-dimethylphenyl)-3-hydroxypropanamide
CID 82112001
5-[(5-methylfuran-2-yl)amino]pentanoic acid
CID 115218913
3-(aminomethyl)-N-(5-methylfuran-2-yl)oxetane-3-carboxamide
CID 115185551
3-chloro-N-[1-(5-methylfuran-2-yl)ethyl]propanamide
CID 43697661
N-(1-hydroxy-3-methylbutan-2-yl)-5-methylfuran-2-carboxamide
CID 79252093
3-hydroxy-N-methyl-N-(5-methylfuran-2-yl)propanamide
CID 115138943
2,5-dimethylfuran;ethanol
CID 160667580
N-(4-ethoxyphenyl)-3-(5-methylfuran-2-yl)propanamide
CID 2243182
N-(4-hydroxybutyl)-5-methylfuran-2-carboxamide
CID 106843396
(5-methylfuran-2-yl)hydrazine
CID 116964871

Frequently Asked Questions

What is the IUPAC name of 3-hydroxy-N-(5-methylfuran-2-yl)propanamide?
The IUPAC name of 3-hydroxy-N-(5-methylfuran-2-yl)propanamide (CID 115138791) is 3-hydroxy-N-(5-methylfuran-2-yl)propanamide.
What is the SMILES notation for 3-hydroxy-N-(5-methylfuran-2-yl)propanamide?
The canonical SMILES for 3-hydroxy-N-(5-methylfuran-2-yl)propanamide is Cc1ccc(NC(=O)CCO)o1.
What is the InChIKey of 3-hydroxy-N-(5-methylfuran-2-yl)propanamide?
The InChIKey is JGEJHAHFSHTDHA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c1-6-2-3-8(12-6)9-7(11)4-5-10/h2-3,10H,4-5H2,1H3,(H,9,11).
What are the key properties of 3-hydroxy-N-(5-methylfuran-2-yl)propanamide?
3-hydroxy-N-(5-methylfuran-2-yl)propanamide has a molecular weight of 169.18 g/mol, XLogP of 0.91, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-hydroxy-N-(5-methylfuran-2-yl)propanamide is sourced from PubChem (CID 115138791), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).