N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide

C11H17NO3 — CID 43572981

IUPACN-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide
SMILESCc1ccc(C(=O)N(CCO)C(C)C)o1
InChIInChI=1S/C11H17NO3/c1-8(2)12(6-7-13)11(14)10-5-4-9(3)15-10/h4-5,8,13H,6-7H2,1-3H3
InChIKeyZMGISIHLCLUGRD-UHFFFAOYSA-N
MW211.26 g/mol
LogP1.43
Rot. Bonds4

About N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide

N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide (PubChem CID 43572981) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide
PubChem CID43572981
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC NameN-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide
SMILESCc1ccc(C(=O)N(CCO)C(C)C)o1
InChIInChI=1S/C11H17NO3/c1-8(2)12(6-7-13)11(14)10-5-4-9(3)15-10/h4-5,8,13H,6-7H2,1-3H3
InChIKeyZMGISIHLCLUGRD-UHFFFAOYSA-N
XLogP1.43
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 51.43
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide (CID 43572981) is N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide is Cc1ccc(C(=O)N(CCO)C(C)C)o1.
What is the InChIKey of N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide?
The InChIKey is ZMGISIHLCLUGRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-8(2)12(6-7-13)11(14)10-5-4-9(3)15-10/h4-5,8,13H,6-7H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide?
N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide has a molecular weight of 211.26 g/mol, XLogP of 1.43, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-5-methyl-N-propan-2-ylfuran-2-carboxamide is sourced from PubChem (CID 43572981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).