morpholin-3-ylmethanamine

C5H12N2O — CID 19045189

IUPACmorpholin-3-ylmethanamine
SMILESNCC1COCCN1
InChIInChI=1S/C5H12N2O/c6-3-5-4-8-2-1-7-5/h5,7H,1-4,6H2
InChIKeyVLHGVSGPYXDAKS-UHFFFAOYSA-N
MW116.16 g/mol
LogP-1.07
Rot. Bonds1

About morpholin-3-ylmethanamine

morpholin-3-ylmethanamine (PubChem CID 19045189) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is morpholin-3-ylmethanamine.

Molecular Properties

Compound Namemorpholin-3-ylmethanamine
PubChem CID19045189
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Namemorpholin-3-ylmethanamine
SMILESNCC1COCCN1
InChIInChI=1S/C5H12N2O/c6-3-5-4-8-2-1-7-5/h5,7H,1-4,6H2
InChIKeyVLHGVSGPYXDAKS-UHFFFAOYSA-N
XLogP-1.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500116.16
LogP ≤ 5-1.07
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of morpholin-3-ylmethanamine?
The IUPAC name of morpholin-3-ylmethanamine (CID 19045189) is morpholin-3-ylmethanamine.
What is the SMILES notation for morpholin-3-ylmethanamine?
The canonical SMILES for morpholin-3-ylmethanamine is NCC1COCCN1.
What is the InChIKey of morpholin-3-ylmethanamine?
The InChIKey is VLHGVSGPYXDAKS-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c6-3-5-4-8-2-1-7-5/h5,7H,1-4,6H2.
What are the key properties of morpholin-3-ylmethanamine?
morpholin-3-ylmethanamine has a molecular weight of 116.16 g/mol, XLogP of -1.07, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for morpholin-3-ylmethanamine is sourced from PubChem (CID 19045189), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).