[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine

C13H26N2O — CID 65158902

IUPAC[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
SMILESNCC1CCN(CCCC2CCCO2)CC1
InChIInChI=1S/C13H26N2O/c14-11-12-5-8-15(9-6-12)7-1-3-13-4-2-10-16-13/h12-13H,1-11,14H2
InChIKeyZLIIJYVUEUJSEO-UHFFFAOYSA-N
MW226.36 g/mol
LogP1.62
Rot. Bonds5

About [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine

[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine (PubChem CID 65158902) has the molecular formula C13H26N2O and a molecular weight of 226.36 g/mol. Its IUPAC name is [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
PubChem CID65158902
Molecular FormulaC13H26N2O
Molecular Weight226.36 g/mol
Exact Mass226.20
IUPAC Name[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
SMILESNCC1CCN(CCCC2CCCO2)CC1
InChIInChI=1S/C13H26N2O/c14-11-12-5-8-15(9-6-12)7-1-3-13-4-2-10-16-13/h12-13H,1-11,14H2
InChIKeyZLIIJYVUEUJSEO-UHFFFAOYSA-N
XLogP1.62
TPSA38.49 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 ≤ 51.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
CID 65159918
(3S)-1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-amine
CID 115302471
N-methyl-1-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
CID 65161247
2-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]acetic acid
CID 79608135
1-[1-[3-(oxolan-2-yl)propyl]pyrrolidin-3-yl]piperidin-4-amine
CID 80553923
2-methyl-N-[[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methyl]propan-1-amine
CID 65161458
3-[4-[2-(oxolan-2-yl)ethyl]-1,4-diazepan-1-yl]propan-1-amine
CID 65158558
2-[4-[3-(oxolan-2-yl)propyl]-1,4-diazepan-1-yl]ethanol
CID 65166537
5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine
CID 65158754
N-ethyl-1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
CID 65159145
1-[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]pyrazol-3-amine
CID 107109665
(3R,4S)-1-[3-(oxolan-2-yl)propyl]pyrrolidine-3,4-diol
CID 79410973

Frequently Asked Questions

What is the IUPAC name of [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine?
The IUPAC name of [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine (CID 65158902) is [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine.
What is the SMILES notation for [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine?
The canonical SMILES for [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine is NCC1CCN(CCCC2CCCO2)CC1.
What is the InChIKey of [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine?
The InChIKey is ZLIIJYVUEUJSEO-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H26N2O/c14-11-12-5-8-15(9-6-12)7-1-3-13-4-2-10-16-13/h12-13H,1-11,14H2.
What are the key properties of [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine?
[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine has a molecular weight of 226.36 g/mol, XLogP of 1.62, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine is sourced from PubChem (CID 65158902), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).