(5R)-5-(aminomethyl)-1,3-oxazinan-2-one

C5H10N2O2 — CID 66596504

IUPAC(5R)-5-(aminomethyl)-1,3-oxazinan-2-one
SMILESNC[C@@H]1CNC(=O)OC1
InChIInChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)9-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m1/s1
InChIKeyWDLKEKHAAYKMOQ-SCSAIBSYSA-N
MW130.15 g/mol
LogP-0.70
Rot. Bonds1

About (5R)-5-(aminomethyl)-1,3-oxazinan-2-one

(5R)-5-(aminomethyl)-1,3-oxazinan-2-one (PubChem CID 66596504) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is (5R)-5-(aminomethyl)-1,3-oxazinan-2-one.

Molecular Properties

Compound Name(5R)-5-(aminomethyl)-1,3-oxazinan-2-one
PubChem CID66596504
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name(5R)-5-(aminomethyl)-1,3-oxazinan-2-one
SMILESNC[C@@H]1CNC(=O)OC1
InChIInChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)9-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m1/s1
InChIKeyWDLKEKHAAYKMOQ-SCSAIBSYSA-N
XLogP-0.70
TPSA64.35 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.15
LogP ≤ 5-0.70
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (5R)-5-(aminomethyl)-1,3-oxazinan-2-one?
The IUPAC name of (5R)-5-(aminomethyl)-1,3-oxazinan-2-one (CID 66596504) is (5R)-5-(aminomethyl)-1,3-oxazinan-2-one.
What is the SMILES notation for (5R)-5-(aminomethyl)-1,3-oxazinan-2-one?
The canonical SMILES for (5R)-5-(aminomethyl)-1,3-oxazinan-2-one is NC[C@@H]1CNC(=O)OC1.
What is the InChIKey of (5R)-5-(aminomethyl)-1,3-oxazinan-2-one?
The InChIKey is WDLKEKHAAYKMOQ-SCSAIBSYSA-N. The full InChI is InChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)9-3-4/h4H,1-3,6H2,(H,7,8)/t4-/m1/s1.
What are the key properties of (5R)-5-(aminomethyl)-1,3-oxazinan-2-one?
(5R)-5-(aminomethyl)-1,3-oxazinan-2-one has a molecular weight of 130.15 g/mol, XLogP of -0.70, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (5R)-5-(aminomethyl)-1,3-oxazinan-2-one is sourced from PubChem (CID 66596504), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).