N-(oxolan-3-yl)piperidin-3-amine

C9H18N2O — CID 80714132

IUPACN-(oxolan-3-yl)piperidin-3-amine
SMILESC1CNCC(NC2CCOC2)C1
InChIInChI=1S/C9H18N2O/c1-2-8(6-10-4-1)11-9-3-5-12-7-9/h8-11H,1-7H2
InChIKeyDIICIUAZIVJBIS-UHFFFAOYSA-N
MW170.26 g/mol
LogP0.12
Rot. Bonds2

About N-(oxolan-3-yl)piperidin-3-amine

N-(oxolan-3-yl)piperidin-3-amine (PubChem CID 80714132) has the molecular formula C9H18N2O and a molecular weight of 170.26 g/mol. Its IUPAC name is N-(oxolan-3-yl)piperidin-3-amine.

Molecular Properties

Compound NameN-(oxolan-3-yl)piperidin-3-amine
PubChem CID80714132
Molecular FormulaC9H18N2O
Molecular Weight170.26 g/mol
Exact Mass170.14
IUPAC NameN-(oxolan-3-yl)piperidin-3-amine
SMILESC1CNCC(NC2CCOC2)C1
InChIInChI=1S/C9H18N2O/c1-2-8(6-10-4-1)11-9-3-5-12-7-9/h8-11H,1-7H2
InChIKeyDIICIUAZIVJBIS-UHFFFAOYSA-N
XLogP0.12
TPSA33.29 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.26
LogP ≤ 50.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(oxolan-3-yl)piperidin-3-amine?
The IUPAC name of N-(oxolan-3-yl)piperidin-3-amine (CID 80714132) is N-(oxolan-3-yl)piperidin-3-amine.
What is the SMILES notation for N-(oxolan-3-yl)piperidin-3-amine?
The canonical SMILES for N-(oxolan-3-yl)piperidin-3-amine is C1CNCC(NC2CCOC2)C1.
What is the InChIKey of N-(oxolan-3-yl)piperidin-3-amine?
The InChIKey is DIICIUAZIVJBIS-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N2O/c1-2-8(6-10-4-1)11-9-3-5-12-7-9/h8-11H,1-7H2.
What are the key properties of N-(oxolan-3-yl)piperidin-3-amine?
N-(oxolan-3-yl)piperidin-3-amine has a molecular weight of 170.26 g/mol, XLogP of 0.12, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(oxolan-3-yl)piperidin-3-amine is sourced from PubChem (CID 80714132), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).