N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine

C12H24N2O — CID 63741708

IUPACN-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine
SMILESCNCC1(CN(C)C2CC2)CCCOC1
InChIInChI=1S/C12H24N2O/c1-13-8-12(6-3-7-15-10-12)9-14(2)11-4-5-11/h11,13H,3-10H2,1-2H3
InChIKeyACUSGDXWNYGORN-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.10
Rot. Bonds5

About N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine

N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine (PubChem CID 63741708) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine.

Molecular Properties

Compound NameN-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine
PubChem CID63741708
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC NameN-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine
SMILESCNCC1(CN(C)C2CC2)CCCOC1
InChIInChI=1S/C12H24N2O/c1-13-8-12(6-3-7-15-10-12)9-14(2)11-4-5-11/h11,13H,3-10H2,1-2H3
InChIKeyACUSGDXWNYGORN-UHFFFAOYSA-N
XLogP1.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine?
The IUPAC name of N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine (CID 63741708) is N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine.
What is the SMILES notation for N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine?
The canonical SMILES for N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine is CNCC1(CN(C)C2CC2)CCCOC1.
What is the InChIKey of N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine?
The InChIKey is ACUSGDXWNYGORN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c1-13-8-12(6-3-7-15-10-12)9-14(2)11-4-5-11/h11,13H,3-10H2,1-2H3.
What are the key properties of N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine?
N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine has a molecular weight of 212.34 g/mol, XLogP of 1.10, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-[[3-(methylaminomethyl)oxan-3-yl]methyl]cyclopropanamine is sourced from PubChem (CID 63741708), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).