6-(aminomethyl)morpholin-3-one

C5H10N2O2 — CID 10057542

IUPAC6-(aminomethyl)morpholin-3-one
SMILESNCC1CNC(=O)CO1
InChIInChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)3-9-4/h4H,1-3,6H2,(H,7,8)
InChIKeyRRAANKOMZXHCIN-UHFFFAOYSA-N
MW130.15 g/mol
LogP-1.54
Rot. Bonds1

About 6-(aminomethyl)morpholin-3-one

6-(aminomethyl)morpholin-3-one (PubChem CID 10057542) has the molecular formula C5H10N2O2 and a molecular weight of 130.15 g/mol. Its IUPAC name is 6-(aminomethyl)morpholin-3-one.

Molecular Properties

Compound Name6-(aminomethyl)morpholin-3-one
PubChem CID10057542
Molecular FormulaC5H10N2O2
Molecular Weight130.15 g/mol
Exact Mass130.07
IUPAC Name6-(aminomethyl)morpholin-3-one
SMILESNCC1CNC(=O)CO1
InChIInChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)3-9-4/h4H,1-3,6H2,(H,7,8)
InChIKeyRRAANKOMZXHCIN-UHFFFAOYSA-N
XLogP-1.54
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 ≤ 5-1.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 6-(aminomethyl)morpholin-3-one?
The IUPAC name of 6-(aminomethyl)morpholin-3-one (CID 10057542) is 6-(aminomethyl)morpholin-3-one.
What is the SMILES notation for 6-(aminomethyl)morpholin-3-one?
The canonical SMILES for 6-(aminomethyl)morpholin-3-one is NCC1CNC(=O)CO1.
What is the InChIKey of 6-(aminomethyl)morpholin-3-one?
The InChIKey is RRAANKOMZXHCIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H10N2O2/c6-1-4-2-7-5(8)3-9-4/h4H,1-3,6H2,(H,7,8).
What are the key properties of 6-(aminomethyl)morpholin-3-one?
6-(aminomethyl)morpholin-3-one has a molecular weight of 130.15 g/mol, XLogP of -1.54, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(aminomethyl)morpholin-3-one is sourced from PubChem (CID 10057542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).