3-(aminomethyl)-N-ethyloxolan-3-amine

C7H16N2O — CID 63335836

IUPAC3-(aminomethyl)-N-ethyloxolan-3-amine
SMILESCCNC1(CN)CCOC1
InChIInChI=1S/C7H16N2O/c1-2-9-7(5-8)3-4-10-6-7/h9H,2-6,8H2,1H3
InChIKeyCYNPXCVDXVCWLZ-UHFFFAOYSA-N
MW144.22 g/mol
LogP-0.29
Rot. Bonds3

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

3-(aminomethyl)-N-ethyloxolan-3-amine (PubChem CID 63335836) has the molecular formula C7H16N2O and a molecular weight of 144.22 g/mol. Its IUPAC name is 3-(aminomethyl)-N-ethyloxolan-3-amine.

Molecular Properties

Compound Name3-(aminomethyl)-N-ethyloxolan-3-amine
PubChem CID63335836
Molecular FormulaC7H16N2O
Molecular Weight144.22 g/mol
Exact Mass144.13
IUPAC Name3-(aminomethyl)-N-ethyloxolan-3-amine
SMILESCCNC1(CN)CCOC1
InChIInChI=1S/C7H16N2O/c1-2-9-7(5-8)3-4-10-6-7/h9H,2-6,8H2,1H3
InChIKeyCYNPXCVDXVCWLZ-UHFFFAOYSA-N
XLogP-0.29
TPSA47.28 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500144.22
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 3-(aminomethyl)-N-ethyloxolan-3-amine?
The IUPAC name of 3-(aminomethyl)-N-ethyloxolan-3-amine (CID 63335836) is 3-(aminomethyl)-N-ethyloxolan-3-amine.
What is the SMILES notation for 3-(aminomethyl)-N-ethyloxolan-3-amine?
The canonical SMILES for 3-(aminomethyl)-N-ethyloxolan-3-amine is CCNC1(CN)CCOC1.
What is the InChIKey of 3-(aminomethyl)-N-ethyloxolan-3-amine?
The InChIKey is CYNPXCVDXVCWLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H16N2O/c1-2-9-7(5-8)3-4-10-6-7/h9H,2-6,8H2,1H3.
What are the key properties of 3-(aminomethyl)-N-ethyloxolan-3-amine?
3-(aminomethyl)-N-ethyloxolan-3-amine has a molecular weight of 144.22 g/mol, XLogP of -0.29, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(aminomethyl)-N-ethyloxolan-3-amine is sourced from PubChem (CID 63335836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).