N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine

C15H28N2O — CID 55051673

IUPACN-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1(CNC2CC2)CCOC1)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-17(14-4-2-3-5-14)11-15(8-9-18-12-15)10-16-13-6-7-13/h13-14,16H,2-12H2,1H3
InChIKeyLLSFUEMMZMMYQA-UHFFFAOYSA-N
MW252.40 g/mol
LogP2.02
Rot. Bonds6

About N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine

N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine (PubChem CID 55051673) has the molecular formula C15H28N2O and a molecular weight of 252.40 g/mol. Its IUPAC name is N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine
PubChem CID55051673
Molecular FormulaC15H28N2O
Molecular Weight252.40 g/mol
Exact Mass252.22
IUPAC NameN-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1(CNC2CC2)CCOC1)C1CCCC1
InChIInChI=1S/C15H28N2O/c1-17(14-4-2-3-5-14)11-15(8-9-18-12-15)10-16-13-6-7-13/h13-14,16H,2-12H2,1H3
InChIKeyLLSFUEMMZMMYQA-UHFFFAOYSA-N
XLogP2.02
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine?
The IUPAC name of N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine (CID 55051673) is N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine is CN(CC1(CNC2CC2)CCOC1)C1CCCC1.
What is the InChIKey of N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine?
The InChIKey is LLSFUEMMZMMYQA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H28N2O/c1-17(14-4-2-3-5-14)11-15(8-9-18-12-15)10-16-13-6-7-13/h13-14,16H,2-12H2,1H3.
What are the key properties of N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine?
N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine has a molecular weight of 252.40 g/mol, XLogP of 2.02, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3-[(cyclopropylamino)methyl]oxolan-3-yl]methyl]-N-methylcyclopentanamine is sourced from PubChem (CID 55051673), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).