N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide

C12H19NO3 — CID 60739984

IUPACN-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCCN(CCO)C(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C12H19NO3/c1-5-13(6-7-14)12(15)11-8(2)9(3)16-10(11)4/h14H,5-7H2,1-4H3
InChIKeyZQVFTDZBZLRHLL-UHFFFAOYSA-N
MW225.29 g/mol
LogP1.66
Rot. Bonds4

About N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide

N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide (PubChem CID 60739984) has the molecular formula C12H19NO3 and a molecular weight of 225.29 g/mol. Its IUPAC name is N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide.

Molecular Properties

Compound NameN-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide
PubChem CID60739984
Molecular FormulaC12H19NO3
Molecular Weight225.29 g/mol
Exact Mass225.14
IUPAC NameN-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide
SMILESCCN(CCO)C(=O)c1c(C)oc(C)c1C
InChIInChI=1S/C12H19NO3/c1-5-13(6-7-14)12(15)11-8(2)9(3)16-10(11)4/h14H,5-7H2,1-4H3
InChIKeyZQVFTDZBZLRHLL-UHFFFAOYSA-N
XLogP1.66
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.29
LogP ≤ 51.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(2-cyanoethyl)-N-ethyl-2,4,5-trimethylfuran-3-carboxamide
CID 65153233
N-ethyl-2,4,5-trimethyl-N-(oxolan-2-ylmethyl)furan-3-carboxamide
CID 75418090
N-ethyl-2,3,4,5,6-pentafluoro-N-(2-hydroxyethyl)benzamide
CID 60722923
N-(2-chloroethyl)-N-(2-methoxyethyl)-2,4,5-trimethylfuran-3-carboxamide
CID 113468246
N,5-diethyl-N-(2-hydroxyethyl)-3-methylfuran-2-carboxamide
CID 109468347
N,3-diethyl-N-(3-hydroxypropyl)-5-methyl-1,2-oxazole-4-carboxamide
CID 115771797
2-[prop-2-enyl-(2,4,5-trimethylfuran-3-carbonyl)amino]acetic acid
CID 79265360
N-ethyl-N-(2-hydroxyethyl)-1,2-oxazole-5-carboxamide
CID 60957663
ethyl(2-hydroxyethyl)carbamic acid
CID 23202017
N-(3-bromopropyl)-2,4,5-trimethyl-N-propan-2-ylfuran-3-carboxamide
CID 80662981
N-ethyl-N-(2-hydroxyethyl)furan-2-carboxamide
CID 39237533
N-[3-(diethylcarbamoyl)phenyl]-2,4,5-trimethylfuran-3-carboxamide
CID 51246740

Frequently Asked Questions

What is the IUPAC name of N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide?
The IUPAC name of N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide (CID 60739984) is N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide.
What is the SMILES notation for N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide?
The canonical SMILES for N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide is CCN(CCO)C(=O)c1c(C)oc(C)c1C.
What is the InChIKey of N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide?
The InChIKey is ZQVFTDZBZLRHLL-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19NO3/c1-5-13(6-7-14)12(15)11-8(2)9(3)16-10(11)4/h14H,5-7H2,1-4H3.
What are the key properties of N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide?
N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide has a molecular weight of 225.29 g/mol, XLogP of 1.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-N-(2-hydroxyethyl)-2,4,5-trimethylfuran-3-carboxamide is sourced from PubChem (CID 60739984), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).