3-(aminomethyl)-N,N-dimethyloxolan-3-amine

C7H16N2O — CID 10606872

IUPAC3-(aminomethyl)-N,N-dimethyloxolan-3-amine
SMILESCN(C)C1(CN)CCOC1
InChIInChI=1S/C7H16N2O/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
InChIKeyPPASVTTXWXCGDO-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.33
Rot. Bonds2

About 3-(aminomethyl)-N,N-dimethyloxolan-3-amine

3-(aminomethyl)-N,N-dimethyloxolan-3-amine (PubChem CID 10606872) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 3-(aminomethyl)-N,N-dimethyloxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N,N-dimethyloxolan-3-amine
PubChem CID10606872
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name3-(aminomethyl)-N,N-dimethyloxolan-3-amine
SMILESCN(C)C1(CN)CCOC1
InChIInChI=1S/C7H16N2O/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3
InChIKeyPPASVTTXWXCGDO-UHFFFAOYSA-N
XLogP-0.33
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N,N-dimethyloxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N,N-dimethyloxolan-3-amine (CID 10606872) is 3-(aminomethyl)-N,N-dimethyloxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N,N-dimethyloxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N,N-dimethyloxolan-3-amine is CN(C)C1(CN)CCOC1.
What is the InChIKey of 3-(aminomethyl)-N,N-dimethyloxolan-3-amine?
The InChIKey is PPASVTTXWXCGDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-9(2)7(5-8)3-4-10-6-7/h3-6,8H2,1-2H3.
What are the key properties of 3-(aminomethyl)-N,N-dimethyloxolan-3-amine?
3-(aminomethyl)-N,N-dimethyloxolan-3-amine has a molecular weight of 144.22 g/mol, XLogP of -0.33, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N,N-dimethyloxolan-3-amine is sourced from PubChem (CID 10606872), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).