N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine

C16H32N2O — CID 62418705

IUPACN-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1CCC(CNC(C)(C)C)O1)C1CCCC1
InChIInChI=1S/C16H32N2O/c1-16(2,3)17-11-14-9-10-15(19-14)12-18(4)13-7-5-6-8-13/h13-15,17H,5-12H2,1-4H3
InChIKeyGGLYKNANBGJAEG-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.80
Rot. Bonds5

About N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine

N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine (PubChem CID 62418705) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine
PubChem CID62418705
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine
SMILESCN(CC1CCC(CNC(C)(C)C)O1)C1CCCC1
InChIInChI=1S/C16H32N2O/c1-16(2,3)17-11-14-9-10-15(19-14)12-18(4)13-7-5-6-8-13/h13-15,17H,5-12H2,1-4H3
InChIKeyGGLYKNANBGJAEG-UHFFFAOYSA-N
XLogP2.80
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine?
The IUPAC name of N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine (CID 62418705) is N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine is CN(CC1CCC(CNC(C)(C)C)O1)C1CCCC1.
What is the InChIKey of N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine?
The InChIKey is GGLYKNANBGJAEG-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-16(2,3)17-11-14-9-10-15(19-14)12-18(4)13-7-5-6-8-13/h13-15,17H,5-12H2,1-4H3.
What are the key properties of N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine?
N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine has a molecular weight of 268.44 g/mol, XLogP of 2.80, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-[(tert-butylamino)methyl]oxolan-2-yl]methyl]-N-methylcyclopentanamine is sourced from PubChem (CID 62418705), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).