N,N-dihydroxycyclopentanamine

C5H11NO2 — CID 18463144

IUPACN,N-dihydroxycyclopentanamine
SMILESON(O)C1CCCC1
InChIInChI=1S/C5H11NO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2
InChIKeyGTHHLCVPAQJIRD-UHFFFAOYSA-N
MW117.15 g/mol
LogP1.01
Rot. Bonds1

About N,N-dihydroxycyclopentanamine

N,N-dihydroxycyclopentanamine (PubChem CID 18463144) has the molecular formula C5H11NO2 and a molecular weight of 117.15 g/mol. Its IUPAC name is N,N-dihydroxycyclopentanamine.

Molecular Properties

Compound NameN,N-dihydroxycyclopentanamine
PubChem CID18463144
Molecular FormulaC5H11NO2
Molecular Weight117.15 g/mol
Exact Mass117.08
IUPAC NameN,N-dihydroxycyclopentanamine
SMILESON(O)C1CCCC1
InChIInChI=1S/C5H11NO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2
InChIKeyGTHHLCVPAQJIRD-UHFFFAOYSA-N
XLogP1.01
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms8
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500117.15
LogP ≤ 51.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N,N-dihydroxycyclopentanamine?
The IUPAC name of N,N-dihydroxycyclopentanamine (CID 18463144) is N,N-dihydroxycyclopentanamine.
What is the SMILES notation for N,N-dihydroxycyclopentanamine?
The canonical SMILES for N,N-dihydroxycyclopentanamine is ON(O)C1CCCC1.
What is the InChIKey of N,N-dihydroxycyclopentanamine?
The InChIKey is GTHHLCVPAQJIRD-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO2/c7-6(8)5-3-1-2-4-5/h5,7-8H,1-4H2.
What are the key properties of N,N-dihydroxycyclopentanamine?
N,N-dihydroxycyclopentanamine has a molecular weight of 117.15 g/mol, XLogP of 1.01, 1 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dihydroxycyclopentanamine is sourced from PubChem (CID 18463144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).