3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide

C11H23N3O2 — CID 64890983

IUPAC3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide
SMILESCN(C)C(C)(C)CNC(=O)C1(N)CCOC1
InChIInChI=1S/C11H23N3O2/c1-10(2,14(3)4)7-13-9(15)11(12)5-6-16-8-11/h5-8,12H2,1-4H3,(H,13,15)
InChIKeyKSYLTTGOOGGSOZ-UHFFFAOYSA-N
MW229.32 g/mol
LogP-0.44
Rot. Bonds4

About 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide

3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide (PubChem CID 64890983) has the molecular formula C11H23N3O2 and a molecular weight of 229.32 g/mol. Its IUPAC name is 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide.

Molecular Properties

Compound Name3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide
PubChem CID64890983
Molecular FormulaC11H23N3O2
Molecular Weight229.32 g/mol
Exact Mass229.18
IUPAC Name3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide
SMILESCN(C)C(C)(C)CNC(=O)C1(N)CCOC1
InChIInChI=1S/C11H23N3O2/c1-10(2,14(3)4)7-13-9(15)11(12)5-6-16-8-11/h5-8,12H2,1-4H3,(H,13,15)
InChIKeyKSYLTTGOOGGSOZ-UHFFFAOYSA-N
XLogP-0.44
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.32
LogP ≤ 5-0.44
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-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide?
The IUPAC name of 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide (CID 64890983) is 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide.
What is the SMILES notation for 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide?
The canonical SMILES for 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide is CN(C)C(C)(C)CNC(=O)C1(N)CCOC1.
What is the InChIKey of 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide?
The InChIKey is KSYLTTGOOGGSOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23N3O2/c1-10(2,14(3)4)7-13-9(15)11(12)5-6-16-8-11/h5-8,12H2,1-4H3,(H,13,15).
What are the key properties of 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide?
3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide has a molecular weight of 229.32 g/mol, XLogP of -0.44, 4 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-N-[2-(dimethylamino)-2-methylpropyl]oxolane-3-carboxamide is sourced from PubChem (CID 64890983), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).