O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride

C5H10ClNO2 — CID 163342975

IUPACO-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride
SMILESC#CCOCCON.Cl
InChIInChI=1S/C5H9NO2.ClH/c1-2-3-7-4-5-8-6;/h1H,3-6H2;1H
InChIKeyUEGAEIQKEHOZOR-UHFFFAOYSA-N
MW151.59 g/mol
LogP-0.05
Rot. Bonds4

About O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride

O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride (PubChem CID 163342975) has the molecular formula C5H10ClNO2 and a molecular weight of 151.59 g/mol. Its IUPAC name is O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride.

Molecular Properties

Compound NameO-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride
PubChem CID163342975
Molecular FormulaC5H10ClNO2
Molecular Weight151.59 g/mol
Exact Mass151.04
IUPAC NameO-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride
SMILESC#CCOCCON.Cl
InChIInChI=1S/C5H9NO2.ClH/c1-2-3-7-4-5-8-6;/h1H,3-6H2;1H
InChIKeyUEGAEIQKEHOZOR-UHFFFAOYSA-N
XLogP-0.05
TPSA44.48 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms9
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.59
LogP ≤ 5-0.05
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

CID 172894425
CID 172894425
3-prop-2-ynoxypropan-1-amine;hydrochloride
CID 154853238
3-[2-[2-[2-(2-bromoethoxy)ethoxy]ethoxy]ethoxy]prop-1-yne
CID 91809458
2-(2-prop-2-ynoxyethoxy)acetonitrile
CID 131979201
ethane;2-(2-prop-2-ynoxyethoxy)ethanamine
CID 144801544
ethane;2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethanamine
CID 170719391
2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 156597060
3-[2-(2-(18F)fluoroethoxy)ethoxy]prop-1-yne
CID 16724484
2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethanol
CID 11506589
2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethoxy]ethanol
CID 130317798
2-[2-[2-(2-prop-2-ynoxyethoxy)ethoxy]ethoxy]ethyl carbamate
CID 175090580
4-prop-2-ynoxybutan-1-amine
CID 126972070

Frequently Asked Questions

What is the IUPAC name of O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride?
The IUPAC name of O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride (CID 163342975) is O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride.
What is the SMILES notation for O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride?
The canonical SMILES for O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride is C#CCOCCON.Cl.
What is the InChIKey of O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride?
The InChIKey is UEGAEIQKEHOZOR-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9NO2.ClH/c1-2-3-7-4-5-8-6;/h1H,3-6H2;1H.
What are the key properties of O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride?
O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride has a molecular weight of 151.59 g/mol, XLogP of -0.05, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for O-(2-prop-2-ynoxyethyl)hydroxylamine;hydrochloride is sourced from PubChem (CID 163342975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).