N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide

C8H11NO3 — CID 15134402

IUPACN-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
SMILESCN(CCO)C(=O)c1ccco1
InChIInChI=1S/C8H11NO3/c1-9(4-5-10)8(11)7-3-2-6-12-7/h2-3,6,10H,4-5H2,1H3
InChIKeyHVDSURQUKMYNTF-UHFFFAOYSA-N
MW169.18 g/mol
LogP0.34
Rot. Bonds3

About N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide

N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide (PubChem CID 15134402) has the molecular formula C8H11NO3 and a molecular weight of 169.18 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
PubChem CID15134402
Molecular FormulaC8H11NO3
Molecular Weight169.18 g/mol
Exact Mass169.07
IUPAC NameN-(2-hydroxyethyl)-N-methylfuran-2-carboxamide
SMILESCN(CCO)C(=O)c1ccco1
InChIInChI=1S/C8H11NO3/c1-9(4-5-10)8(11)7-3-2-6-12-7/h2-3,6,10H,4-5H2,1H3
InChIKeyHVDSURQUKMYNTF-UHFFFAOYSA-N
XLogP0.34
TPSA53.68 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.18
LogP ≤ 50.34
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide (CID 15134402) is N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide is CN(CCO)C(=O)c1ccco1.
What is the InChIKey of N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide?
The InChIKey is HVDSURQUKMYNTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H11NO3/c1-9(4-5-10)8(11)7-3-2-6-12-7/h2-3,6,10H,4-5H2,1H3.
What are the key properties of N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide?
N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide has a molecular weight of 169.18 g/mol, XLogP of 0.34, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-hydroxyethyl)-N-methylfuran-2-carboxamide is sourced from PubChem (CID 15134402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).