2-(5-aminopentylamino)oxyethanol

C7H18N2O2 — CID 88588722

IUPAC2-(5-aminopentylamino)oxyethanol
SMILESNCCCCCNOCCO
InChIInChI=1S/C7H18N2O2/c8-4-2-1-3-5-9-11-7-6-10/h9-10H,1-8H2
InChIKeyPOGVSOSLZCKNFS-UHFFFAOYSA-N
MW162.23 g/mol
LogP-0.37
Rot. Bonds8

About 2-(5-aminopentylamino)oxyethanol

2-(5-aminopentylamino)oxyethanol (PubChem CID 88588722) has the molecular formula C7H18N2O2 and a molecular weight of 162.23 g/mol. Its IUPAC name is 2-(5-aminopentylamino)oxyethanol.

Molecular Properties

Compound Name2-(5-aminopentylamino)oxyethanol
PubChem CID88588722
Molecular FormulaC7H18N2O2
Molecular Weight162.23 g/mol
Exact Mass162.14
IUPAC Name2-(5-aminopentylamino)oxyethanol
SMILESNCCCCCNOCCO
InChIInChI=1S/C7H18N2O2/c8-4-2-1-3-5-9-11-7-6-10/h9-10H,1-8H2
InChIKeyPOGVSOSLZCKNFS-UHFFFAOYSA-N
XLogP-0.37
TPSA67.51 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500162.23
LogP ≤ 5-0.37
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

dodecan-1-amine;2-(2-hydroxyethoxyamino)oxyethanol;sulfuric acid
CID 175057935
2-(3-trimethoxysilylpropylamino)oxyethanol
CID 172861713
N-(12-aminododecoxy)hydroxylamine
CID 175865431
2-[3-(3-aminopropoxy)propoxy]ethanol
CID 87504728
7-amino-N-[3-(2-hydroxyethoxy)propyl]heptanamide
CID 106310658
36-aminohexatriacontan-1-ol
CID 87686190
N'-(2-aminoethoxy)ethane-1,2-diamine
CID 54074422
N'-[(2-methylpropan-2-yl)oxy]hexane-1,6-diamine
CID 162514509
2-[2-[2-[2-(2-aminoethylamino)ethoxy]ethoxy]ethoxy]ethanol
CID 19879172
2-(2-aminoethoxy)ethanol;3-[2-[2-[2-[2-(3-aminopropoxy)ethoxy]ethylamino]ethoxy]ethoxy]propan-1-amine
CID 88780481
6-aminohexan-1-ol;hydrochloride
CID 21259387
N'-(6-aminohexyl)hexane-1,6-diamine;N'-(5-aminopentyl)pentane-1,5-diamine
CID 87880552

Frequently Asked Questions

What is the IUPAC name of 2-(5-aminopentylamino)oxyethanol?
The IUPAC name of 2-(5-aminopentylamino)oxyethanol (CID 88588722) is 2-(5-aminopentylamino)oxyethanol.
What is the SMILES notation for 2-(5-aminopentylamino)oxyethanol?
The canonical SMILES for 2-(5-aminopentylamino)oxyethanol is NCCCCCNOCCO.
What is the InChIKey of 2-(5-aminopentylamino)oxyethanol?
The InChIKey is POGVSOSLZCKNFS-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H18N2O2/c8-4-2-1-3-5-9-11-7-6-10/h9-10H,1-8H2.
What are the key properties of 2-(5-aminopentylamino)oxyethanol?
2-(5-aminopentylamino)oxyethanol has a molecular weight of 162.23 g/mol, XLogP of -0.37, 8 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(5-aminopentylamino)oxyethanol is sourced from PubChem (CID 88588722), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).