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

C12H24N2O — CID 65159918

IUPAC1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
SMILESNC1CCN(CCCC2CCCO2)CC1
InChIInChI=1S/C12H24N2O/c13-11-5-8-14(9-6-11)7-1-3-12-4-2-10-15-12/h11-12H,1-10,13H2
InChIKeyFJUHWIFEDPQCNO-UHFFFAOYSA-N
MW212.34 g/mol
LogP1.37
Rot. Bonds4

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

1-[3-(oxolan-2-yl)propyl]piperidin-4-amine (PubChem CID 65159918) has the molecular formula C12H24N2O and a molecular weight of 212.34 g/mol. Its IUPAC name is 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine.

Molecular Properties

Compound Name1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
PubChem CID65159918
Molecular FormulaC12H24N2O
Molecular Weight212.34 g/mol
Exact Mass212.19
IUPAC Name1-[3-(oxolan-2-yl)propyl]piperidin-4-amine
SMILESNC1CCN(CCCC2CCCO2)CC1
InChIInChI=1S/C12H24N2O/c13-11-5-8-14(9-6-11)7-1-3-12-4-2-10-15-12/h11-12H,1-10,13H2
InChIKeyFJUHWIFEDPQCNO-UHFFFAOYSA-N
XLogP1.37
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms15
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.34
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
The IUPAC name of 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine (CID 65159918) is 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine.
What is the SMILES notation for 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
The canonical SMILES for 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine is NC1CCN(CCCC2CCCO2)CC1.
What is the InChIKey of 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
The InChIKey is FJUHWIFEDPQCNO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N2O/c13-11-5-8-14(9-6-11)7-1-3-12-4-2-10-15-12/h11-12H,1-10,13H2.
What are the key properties of 1-[3-(oxolan-2-yl)propyl]piperidin-4-amine?
1-[3-(oxolan-2-yl)propyl]piperidin-4-amine has a molecular weight of 212.34 g/mol, XLogP of 1.37, 4 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-amine is sourced from PubChem (CID 65159918), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).