N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine

C14H28N2O — CID 65160987

IUPACN-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(CCC2CCCO2)C1
InChIInChI=1S/C14H28N2O/c1-2-15-11-13-5-3-8-16(12-13)9-7-14-6-4-10-17-14/h13-15H,2-12H2,1H3
InChIKeyKGIQPPWEJHZQRR-UHFFFAOYSA-N
MW240.39 g/mol
LogP1.88
Rot. Bonds6

About N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine

N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine (PubChem CID 65160987) has the molecular formula C14H28N2O and a molecular weight of 240.39 g/mol. Its IUPAC name is N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine.

Molecular Properties

Compound NameN-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine
PubChem CID65160987
Molecular FormulaC14H28N2O
Molecular Weight240.39 g/mol
Exact Mass240.22
IUPAC NameN-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine
SMILESCCNCC1CCCN(CCC2CCCO2)C1
InChIInChI=1S/C14H28N2O/c1-2-15-11-13-5-3-8-16(12-13)9-7-14-6-4-10-17-14/h13-15H,2-12H2,1H3
InChIKeyKGIQPPWEJHZQRR-UHFFFAOYSA-N
XLogP1.88
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.39
LogP ≤ 51.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]propan-1-amine
CID 65161038
N-[[1-(2-morpholin-4-ylethyl)piperidin-3-yl]methyl]ethanamine
CID 62581307
N-[[1-[3-(oxolan-2-yl)propyl]piperidin-3-yl]methyl]propan-2-amine
CID 65161095
N-[(1-ethylpyrrolidin-3-yl)methyl]-2-(oxolan-2-yl)ethanamine
CID 65163830
N-[[1-(3-methylbutyl)piperidin-3-yl]methyl]ethanamine
CID 62581148
[1-[3-(oxolan-2-yl)propyl]piperidin-3-yl]methanol
CID 65166006
N-[[1-[2-[(2-methylpropan-2-yl)oxy]ethyl]piperidin-3-yl]methyl]ethanamine
CID 112589860
3-chloro-1-[2-(oxolan-2-yl)ethyl]piperidine
CID 65165784
5-[3-(ethylaminomethyl)piperidin-1-yl]pentan-1-ol
CID 63848813
4-[3-(ethylaminomethyl)piperidin-1-yl]-2-methylbutan-2-ol
CID 79354793
3-methyl-1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
CID 114502307
3-(2-chloroethyl)-1-[3-(oxolan-2-yl)propyl]piperidine
CID 65165279

Frequently Asked Questions

What is the IUPAC name of N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine?
The IUPAC name of N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine (CID 65160987) is N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine.
What is the SMILES notation for N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine?
The canonical SMILES for N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine is CCNCC1CCCN(CCC2CCCO2)C1.
What is the InChIKey of N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine?
The InChIKey is KGIQPPWEJHZQRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H28N2O/c1-2-15-11-13-5-3-8-16(12-13)9-7-14-6-4-10-17-14/h13-15H,2-12H2,1H3.
What are the key properties of N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine?
N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine has a molecular weight of 240.39 g/mol, XLogP of 1.88, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-[2-(oxolan-2-yl)ethyl]piperidin-3-yl]methyl]ethanamine is sourced from PubChem (CID 65160987), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).