4-(piperidin-1-ylmethyl)oxolan-3-amine

C10H20N2O — CID 66237116

IUPAC4-(piperidin-1-ylmethyl)oxolan-3-amine
SMILESNC1COCC1CN1CCCCC1
InChIInChI=1S/C10H20N2O/c11-10-8-13-7-9(10)6-12-4-2-1-3-5-12/h9-10H,1-8,11H2
InChIKeyXYLUFUZMRCHFRI-UHFFFAOYSA-N
MW184.28 g/mol
LogP0.45
Rot. Bonds2

About 4-(piperidin-1-ylmethyl)oxolan-3-amine

4-(piperidin-1-ylmethyl)oxolan-3-amine (PubChem CID 66237116) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is 4-(piperidin-1-ylmethyl)oxolan-3-amine.

Molecular Properties

Compound Name4-(piperidin-1-ylmethyl)oxolan-3-amine
PubChem CID66237116
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name4-(piperidin-1-ylmethyl)oxolan-3-amine
SMILESNC1COCC1CN1CCCCC1
InChIInChI=1S/C10H20N2O/c11-10-8-13-7-9(10)6-12-4-2-1-3-5-12/h9-10H,1-8,11H2
InChIKeyXYLUFUZMRCHFRI-UHFFFAOYSA-N
XLogP0.45
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(piperidin-1-ylmethyl)oxolan-3-amine?
The IUPAC name of 4-(piperidin-1-ylmethyl)oxolan-3-amine (CID 66237116) is 4-(piperidin-1-ylmethyl)oxolan-3-amine.
What is the SMILES notation for 4-(piperidin-1-ylmethyl)oxolan-3-amine?
The canonical SMILES for 4-(piperidin-1-ylmethyl)oxolan-3-amine is NC1COCC1CN1CCCCC1.
What is the InChIKey of 4-(piperidin-1-ylmethyl)oxolan-3-amine?
The InChIKey is XYLUFUZMRCHFRI-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O/c11-10-8-13-7-9(10)6-12-4-2-1-3-5-12/h9-10H,1-8,11H2.
What are the key properties of 4-(piperidin-1-ylmethyl)oxolan-3-amine?
4-(piperidin-1-ylmethyl)oxolan-3-amine has a molecular weight of 184.28 g/mol, XLogP of 0.45, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(piperidin-1-ylmethyl)oxolan-3-amine is sourced from PubChem (CID 66237116), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).