3-(aminomethyl)-N-methyloxetan-3-amine

C5H12N2O — CID 86691410

IUPAC3-(aminomethyl)-N-methyloxetan-3-amine
SMILESCNC1(CN)COC1
InChIInChI=1S/C5H12N2O/c1-7-5(2-6)3-8-4-5/h7H,2-4,6H2,1H3
InChIKeyLTLBZEFYDCAELT-UHFFFAOYSA-N
MW116.16 g/mol
LogP-1.07
Rot. Bonds2

About 3-(aminomethyl)-N-methyloxetan-3-amine

3-(aminomethyl)-N-methyloxetan-3-amine (PubChem CID 86691410) has the molecular formula C5H12N2O and a molecular weight of 116.16 g/mol. Its IUPAC name is 3-(aminomethyl)-N-methyloxetan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-methyloxetan-3-amine
PubChem CID86691410
Molecular FormulaC5H12N2O
Molecular Weight116.16 g/mol
Exact Mass116.09
IUPAC Name3-(aminomethyl)-N-methyloxetan-3-amine
SMILESCNC1(CN)COC1
InChIInChI=1S/C5H12N2O/c1-7-5(2-6)3-8-4-5/h7H,2-4,6H2,1H3
InChIKeyLTLBZEFYDCAELT-UHFFFAOYSA-N
XLogP-1.07
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
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 3-(aminomethyl)-N-methyloxetan-3-amine?
The IUPAC name of 3-(aminomethyl)-N-methyloxetan-3-amine (CID 86691410) is 3-(aminomethyl)-N-methyloxetan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-methyloxetan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-methyloxetan-3-amine is CNC1(CN)COC1.
What is the InChIKey of 3-(aminomethyl)-N-methyloxetan-3-amine?
The InChIKey is LTLBZEFYDCAELT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H12N2O/c1-7-5(2-6)3-8-4-5/h7H,2-4,6H2,1H3.
What are the key properties of 3-(aminomethyl)-N-methyloxetan-3-amine?
3-(aminomethyl)-N-methyloxetan-3-amine has a molecular weight of 116.16 g/mol, XLogP of -1.07, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-methyloxetan-3-amine is sourced from PubChem (CID 86691410), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).