N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide

C11H21NO3 — CID 114826169

IUPACN-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide
SMILESCC1CC(C(=O)N(CCO)C(C)C)CO1
InChIInChI=1S/C11H21NO3/c1-8(2)12(4-5-13)11(14)10-6-9(3)15-7-10/h8-10,13H,4-7H2,1-3H3
InChIKeyYXLHCPGSIYQUNR-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.64
Rot. Bonds4

About N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide

N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide (PubChem CID 114826169) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide
PubChem CID114826169
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide
SMILESCC1CC(C(=O)N(CCO)C(C)C)CO1
InChIInChI=1S/C11H21NO3/c1-8(2)12(4-5-13)11(14)10-6-9(3)15-7-10/h8-10,13H,4-7H2,1-3H3
InChIKeyYXLHCPGSIYQUNR-UHFFFAOYSA-N
XLogP0.64
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.64
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-yloxolane-3-carboxamide?
The IUPAC name of N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide (CID 114826169) is N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide.
What is the SMILES notation for N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide?
The canonical SMILES for N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide is CC1CC(C(=O)N(CCO)C(C)C)CO1.
What is the InChIKey of N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide?
The InChIKey is YXLHCPGSIYQUNR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-8(2)12(4-5-13)11(14)10-6-9(3)15-7-10/h8-10,13H,4-7H2,1-3H3.
What are the key properties of N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide?
N-(2-hydroxyethyl)-5-methyl-N-propan-2-yloxolane-3-carboxamide has a molecular weight of 215.29 g/mol, XLogP of 0.64, 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-yloxolane-3-carboxamide is sourced from PubChem (CID 114826169), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).