5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine

C15H31N3O — CID 65158754

IUPAC5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine
SMILESNCCCCCN1CCN(CCC2CCCO2)CC1
InChIInChI=1S/C15H31N3O/c16-7-2-1-3-8-17-10-12-18(13-11-17)9-6-15-5-4-14-19-15/h15H,1-14,16H2
InChIKeyREKSFERYZDJOPN-UHFFFAOYSA-N
MW269.43 g/mol
LogP1.30
Rot. Bonds8

About 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine

5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine (PubChem CID 65158754) has the molecular formula C15H31N3O and a molecular weight of 269.43 g/mol. Its IUPAC name is 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine.

Molecular Properties

Compound Name5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine
PubChem CID65158754
Molecular FormulaC15H31N3O
Molecular Weight269.43 g/mol
Exact Mass269.25
IUPAC Name5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine
SMILESNCCCCCN1CCN(CCC2CCCO2)CC1
InChIInChI=1S/C15H31N3O/c16-7-2-1-3-8-17-10-12-18(13-11-17)9-6-15-5-4-14-19-15/h15H,1-14,16H2
InChIKeyREKSFERYZDJOPN-UHFFFAOYSA-N
XLogP1.30
TPSA41.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 51.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

3-[4-[2-(oxolan-2-yl)ethyl]-1,4-diazepan-1-yl]propan-1-amine
CID 65158558
5-[4-(oxolan-2-ylmethyl)piperazin-1-yl]pentan-1-amine
CID 43253069
4-[4-(oxan-2-ylmethyl)piperazin-1-yl]butan-1-amine
CID 43591824
3-[4-(oxolan-2-ylmethyl)piperazin-1-yl]propan-1-amine
CID 16768404
1-(2-bromoethyl)-4-[2-(oxolan-2-yl)ethyl]piperazine
CID 80673810
4-[2-(oxolan-2-yl)ethyl]morpholine
CID 130172160
[1-[3-(oxolan-2-yl)propyl]piperidin-4-yl]methanamine
CID 65158902
1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
CID 65159918
1-[2-(oxolan-2-yl)ethyl]piperidin-4-ol
CID 65165900
2-methyl-3-[4-[2-(oxolan-2-yl)ethyl]-1,4-diazepan-1-yl]propan-1-amine
CID 65158752
2-[4-[3-(oxolan-2-yl)propyl]-1,4-diazepan-1-yl]ethanol
CID 65166537
N'-hydroxy-2-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]ethanimidamide
CID 77057944

Frequently Asked Questions

What is the IUPAC name of 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine?
The IUPAC name of 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine (CID 65158754) is 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine.
What is the SMILES notation for 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine?
The canonical SMILES for 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine is NCCCCCN1CCN(CCC2CCCO2)CC1.
What is the InChIKey of 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine?
The InChIKey is REKSFERYZDJOPN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31N3O/c16-7-2-1-3-8-17-10-12-18(13-11-17)9-6-15-5-4-14-19-15/h15H,1-14,16H2.
What are the key properties of 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine?
5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine has a molecular weight of 269.43 g/mol, XLogP of 1.30, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[4-[2-(oxolan-2-yl)ethyl]piperazin-1-yl]pentan-1-amine is sourced from PubChem (CID 65158754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).