N-methyl-2-(oxolan-2-yl)ethanamine

C7H15NO — CID 20773508

IUPACN-methyl-2-(oxolan-2-yl)ethanamine
SMILESCNCCC1CCCO1
InChIInChI=1S/C7H15NO/c1-8-5-4-7-3-2-6-9-7/h7-8H,2-6H2,1H3
InChIKeyKHXLJWOBDMGMCQ-UHFFFAOYSA-N
MW129.20 g/mol
LogP0.77
Rot. Bonds3

About N-methyl-2-(oxolan-2-yl)ethanamine

N-methyl-2-(oxolan-2-yl)ethanamine (PubChem CID 20773508) has the molecular formula C7H15NO and a molecular weight of 129.20 g/mol. Its IUPAC name is N-methyl-2-(oxolan-2-yl)ethanamine.

Molecular Properties

Compound NameN-methyl-2-(oxolan-2-yl)ethanamine
PubChem CID20773508
Molecular FormulaC7H15NO
Molecular Weight129.20 g/mol
Exact Mass129.12
IUPAC NameN-methyl-2-(oxolan-2-yl)ethanamine
SMILESCNCCC1CCCO1
InChIInChI=1S/C7H15NO/c1-8-5-4-7-3-2-6-9-7/h7-8H,2-6H2,1H3
InChIKeyKHXLJWOBDMGMCQ-UHFFFAOYSA-N
XLogP0.77
TPSA21.26 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500129.20
LogP ≤ 50.77
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of N-methyl-2-(oxolan-2-yl)ethanamine?
The IUPAC name of N-methyl-2-(oxolan-2-yl)ethanamine (CID 20773508) is N-methyl-2-(oxolan-2-yl)ethanamine.
What is the SMILES notation for N-methyl-2-(oxolan-2-yl)ethanamine?
The canonical SMILES for N-methyl-2-(oxolan-2-yl)ethanamine is CNCCC1CCCO1.
What is the InChIKey of N-methyl-2-(oxolan-2-yl)ethanamine?
The InChIKey is KHXLJWOBDMGMCQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15NO/c1-8-5-4-7-3-2-6-9-7/h7-8H,2-6H2,1H3.
What are the key properties of N-methyl-2-(oxolan-2-yl)ethanamine?
N-methyl-2-(oxolan-2-yl)ethanamine has a molecular weight of 129.20 g/mol, XLogP of 0.77, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-2-(oxolan-2-yl)ethanamine is sourced from PubChem (CID 20773508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).