N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide

C11H21NO3 — CID 66804115

IUPACN-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide
SMILESCC(CO)NC(=O)C1COCC1C(C)C
InChIInChI=1S/C11H21NO3/c1-7(2)9-5-15-6-10(9)11(14)12-8(3)4-13/h7-10,13H,4-6H2,1-3H3,(H,12,14)
InChIKeyVTEJZCKUZFELGT-UHFFFAOYSA-N
MW215.29 g/mol
LogP0.40
Rot. Bonds4

About N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide

N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide (PubChem CID 66804115) has the molecular formula C11H21NO3 and a molecular weight of 215.29 g/mol. Its IUPAC name is N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide.

Molecular Properties

Compound NameN-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide
PubChem CID66804115
Molecular FormulaC11H21NO3
Molecular Weight215.29 g/mol
Exact Mass215.15
IUPAC NameN-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide
SMILESCC(CO)NC(=O)C1COCC1C(C)C
InChIInChI=1S/C11H21NO3/c1-7(2)9-5-15-6-10(9)11(14)12-8(3)4-13/h7-10,13H,4-6H2,1-3H3,(H,12,14)
InChIKeyVTEJZCKUZFELGT-UHFFFAOYSA-N
XLogP0.40
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.29
LogP ≤ 50.40
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide?
The IUPAC name of N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide (CID 66804115) is N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide.
What is the SMILES notation for N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide?
The canonical SMILES for N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide is CC(CO)NC(=O)C1COCC1C(C)C.
What is the InChIKey of N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide?
The InChIKey is VTEJZCKUZFELGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H21NO3/c1-7(2)9-5-15-6-10(9)11(14)12-8(3)4-13/h7-10,13H,4-6H2,1-3H3,(H,12,14).
What are the key properties of N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide?
N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide has a molecular weight of 215.29 g/mol, XLogP of 0.40, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-hydroxypropan-2-yl)-4-propan-2-yloxolane-3-carboxamide is sourced from PubChem (CID 66804115), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).