3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide

C10H20N2O3 — CID 79378741

IUPAC3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide
SMILESCN(CC(C)(C)O)C(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O3/c1-9(2,14)6-12(3)8(13)10(11)4-5-15-7-10/h14H,4-7,11H2,1-3H3
InChIKeyRLWWQEICSYLRLY-UHFFFAOYSA-N
MW216.28 g/mol
LogP-0.67
Rot. Bonds3

About 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide

3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide (PubChem CID 79378741) has the molecular formula C10H20N2O3 and a molecular weight of 216.28 g/mol. Its IUPAC name is 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide
PubChem CID79378741
Molecular FormulaC10H20N2O3
Molecular Weight216.28 g/mol
Exact Mass216.15
IUPAC Name3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide
SMILESCN(CC(C)(C)O)C(=O)C1(N)CCOC1
InChIInChI=1S/C10H20N2O3/c1-9(2,14)6-12(3)8(13)10(11)4-5-15-7-10/h14H,4-7,11H2,1-3H3
InChIKeyRLWWQEICSYLRLY-UHFFFAOYSA-N
XLogP-0.67
TPSA75.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.28
LogP ≤ 5-0.67
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide?
The IUPAC name of 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide (CID 79378741) is 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide is CN(CC(C)(C)O)C(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide?
The InChIKey is RLWWQEICSYLRLY-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O3/c1-9(2,14)6-12(3)8(13)10(11)4-5-15-7-10/h14H,4-7,11H2,1-3H3.
What are the key properties of 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide?
3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide has a molecular weight of 216.28 g/mol, XLogP of -0.67, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-(2-hydroxy-2-methylpropyl)-N-methyloxolane-3-carboxamide is sourced from PubChem (CID 79378741), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).