N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine

C14H28N2O — CID 82743146

IUPACN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
SMILESCNC1C(CN(C)C2CCOC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-5-11(13(14)15-3)9-16(4)12-6-8-17-10-12/h11-13,15H,5-10H2,1-4H3
InChIKeyFKZVBVYVMBVALI-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.73
Rot. Bonds4

About N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine

N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine (PubChem CID 82743146) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine.

Molecular Properties

Compound NameN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
PubChem CID82743146
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine
SMILESCNC1C(CN(C)C2CCOC2)CCC1(C)C
InChIInChI=1S/C14H28N2O/c1-14(2)7-5-11(13(14)15-3)9-16(4)12-6-8-17-10-12/h11-13,15H,5-10H2,1-4H3
InChIKeyFKZVBVYVMBVALI-UHFFFAOYSA-N
XLogP1.73
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.73
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine?
The IUPAC name of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine (CID 82743146) is N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine.
What is the SMILES notation for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine?
The canonical SMILES for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine is CNC1C(CN(C)C2CCOC2)CCC1(C)C.
What is the InChIKey of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine?
The InChIKey is FKZVBVYVMBVALI-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-14(2)7-5-11(13(14)15-3)9-16(4)12-6-8-17-10-12/h11-13,15H,5-10H2,1-4H3.
What are the key properties of N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine?
N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine has a molecular weight of 240.39 g/mol, XLogP of 1.73, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[3,3-dimethyl-2-(methylamino)cyclopentyl]methyl]-N-methyloxolan-3-amine is sourced from PubChem (CID 82743146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).