3-[(dimethylamino)methyl]oxetan-3-amine

C6H14N2O — CID 90126871

IUPAC3-[(dimethylamino)methyl]oxetan-3-amine
SMILESCN(C)CC1(N)COC1
InChIInChI=1S/C6H14N2O/c1-8(2)3-6(7)4-9-5-6/h3-5,7H2,1-2H3
InChIKeyRZWRQUFBZAUQKV-UHFFFAOYSA-N
MW130.19 g/mol
LogP-0.72
Rot. Bonds2

About 3-[(dimethylamino)methyl]oxetan-3-amine

3-[(dimethylamino)methyl]oxetan-3-amine (PubChem CID 90126871) has the molecular formula C6H14N2O and a molecular weight of 130.19 g/mol. Its IUPAC name is 3-[(dimethylamino)methyl]oxetan-3-amine.

Molecular Properties

Compound Name3-[(dimethylamino)methyl]oxetan-3-amine
PubChem CID90126871
Molecular FormulaC6H14N2O
Molecular Weight130.19 g/mol
Exact Mass130.11
IUPAC Name3-[(dimethylamino)methyl]oxetan-3-amine
SMILESCN(C)CC1(N)COC1
InChIInChI=1S/C6H14N2O/c1-8(2)3-6(7)4-9-5-6/h3-5,7H2,1-2H3
InChIKeyRZWRQUFBZAUQKV-UHFFFAOYSA-N
XLogP-0.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500130.19
LogP ≤ 5-0.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-[(dimethylamino)methyl]oxetan-3-amine?
The IUPAC name of 3-[(dimethylamino)methyl]oxetan-3-amine (CID 90126871) is 3-[(dimethylamino)methyl]oxetan-3-amine.
What is the SMILES notation for 3-[(dimethylamino)methyl]oxetan-3-amine?
The canonical SMILES for 3-[(dimethylamino)methyl]oxetan-3-amine is CN(C)CC1(N)COC1.
What is the InChIKey of 3-[(dimethylamino)methyl]oxetan-3-amine?
The InChIKey is RZWRQUFBZAUQKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H14N2O/c1-8(2)3-6(7)4-9-5-6/h3-5,7H2,1-2H3.
What are the key properties of 3-[(dimethylamino)methyl]oxetan-3-amine?
3-[(dimethylamino)methyl]oxetan-3-amine has a molecular weight of 130.19 g/mol, XLogP of -0.72, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[(dimethylamino)methyl]oxetan-3-amine is sourced from PubChem (CID 90126871), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).