N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine

C13H26N2O — CID 56711089

IUPACN-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine
SMILESCN(CCCC1CCCO1)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-15(12-6-8-14-9-7-12)10-2-4-13-5-3-11-16-13/h12-14H,2-11H2,1H3
InChIKeyLVAMJBIFPIAFMK-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.63
Rot. Bonds5

About N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine

N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine (PubChem CID 56711089) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine.

Molecular Properties

Compound NameN-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine
PubChem CID56711089
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC NameN-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine
SMILESCN(CCCC1CCCO1)C1CCNCC1
InChIInChI=1S/C13H26N2O/c1-15(12-6-8-14-9-7-12)10-2-4-13-5-3-11-16-13/h12-14H,2-11H2,1H3
InChIKeyLVAMJBIFPIAFMK-UHFFFAOYSA-N
XLogP1.63
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.36
LogP ≤ 51.63
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-(oxolan-2-yl)propyl]piperidin-4-amine?
The IUPAC name of N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine (CID 56711089) is N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine.
What is the SMILES notation for N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
The canonical SMILES for N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine is CN(CCCC1CCCO1)C1CCNCC1.
What is the InChIKey of N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
The InChIKey is LVAMJBIFPIAFMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c1-15(12-6-8-14-9-7-12)10-2-4-13-5-3-11-16-13/h12-14H,2-11H2,1H3.
What are the key properties of N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
N-methyl-N-[3-(oxolan-2-yl)propyl]piperidin-4-amine has a molecular weight of 226.36 g/mol, XLogP of 1.63, 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-(oxolan-2-yl)propyl]piperidin-4-amine is sourced from PubChem (CID 56711089), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).