4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide

C10H17N3O3 — CID 66235670

IUPAC4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NC1CCCNC1=O
InChIInChI=1S/C10H17N3O3/c11-7-5-16-4-6(7)9(14)13-8-2-1-3-12-10(8)15/h6-8H,1-5,11H2,(H,12,15)(H,13,14)
InChIKeyVVQPMUGDWAXVGG-UHFFFAOYSA-N
MW227.26 g/mol
LogP-1.65
Rot. Bonds2

About 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide

4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide (PubChem CID 66235670) has the molecular formula C10H17N3O3 and a molecular weight of 227.26 g/mol. Its IUPAC name is 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide.

Molecular Properties

Compound Name4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide
PubChem CID66235670
Molecular FormulaC10H17N3O3
Molecular Weight227.26 g/mol
Exact Mass227.13
IUPAC Name4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide
SMILESNC1COCC1C(=O)NC1CCCNC1=O
InChIInChI=1S/C10H17N3O3/c11-7-5-16-4-6(7)9(14)13-8-2-1-3-12-10(8)15/h6-8H,1-5,11H2,(H,12,15)(H,13,14)
InChIKeyVVQPMUGDWAXVGG-UHFFFAOYSA-N
XLogP-1.65
TPSA93.45 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms16
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.26
LogP ≤ 5-1.65
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide?
The IUPAC name of 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide (CID 66235670) is 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide.
What is the SMILES notation for 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide?
The canonical SMILES for 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide is NC1COCC1C(=O)NC1CCCNC1=O.
What is the InChIKey of 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide?
The InChIKey is VVQPMUGDWAXVGG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N3O3/c11-7-5-16-4-6(7)9(14)13-8-2-1-3-12-10(8)15/h6-8H,1-5,11H2,(H,12,15)(H,13,14).
What are the key properties of 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide?
4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide has a molecular weight of 227.26 g/mol, XLogP of -1.65, 2 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-amino-N-(2-oxopiperidin-3-yl)oxolane-3-carboxamide is sourced from PubChem (CID 66235670), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).