2-hydroxypropanimidamide;hydrochloride

C3H9ClN2O — CID 22328699

IUPAC2-hydroxypropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C(C)O
InChIInChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H
InChIKeyAEOZCEMLLBCHQZ-UHFFFAOYSA-N
MW124.57 g/mol
LogP-0.28
Rot. Bonds1

About 2-hydroxypropanimidamide;hydrochloride

2-hydroxypropanimidamide;hydrochloride (PubChem CID 22328699) has the molecular formula C3H9ClN2O and a molecular weight of 124.57 g/mol. Its IUPAC name is 2-hydroxypropanimidamide;hydrochloride.

Molecular Properties

Compound Name2-hydroxypropanimidamide;hydrochloride
PubChem CID22328699
Molecular FormulaC3H9ClN2O
Molecular Weight124.57 g/mol
Exact Mass124.04
IUPAC Name2-hydroxypropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)C(C)O
InChIInChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H
InChIKeyAEOZCEMLLBCHQZ-UHFFFAOYSA-N
XLogP-0.28
TPSA70.10 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500124.57
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 2-hydroxypropanimidamide;hydrochloride?
The IUPAC name of 2-hydroxypropanimidamide;hydrochloride (CID 22328699) is 2-hydroxypropanimidamide;hydrochloride.
What is the SMILES notation for 2-hydroxypropanimidamide;hydrochloride?
The canonical SMILES for 2-hydroxypropanimidamide;hydrochloride is Cl.[H]/N=C(\N)C(C)O.
What is the InChIKey of 2-hydroxypropanimidamide;hydrochloride?
The InChIKey is AEOZCEMLLBCHQZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H8N2O.ClH/c1-2(6)3(4)5;/h2,6H,1H3,(H3,4,5);1H.
What are the key properties of 2-hydroxypropanimidamide;hydrochloride?
2-hydroxypropanimidamide;hydrochloride has a molecular weight of 124.57 g/mol, XLogP of -0.28, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-hydroxypropanimidamide;hydrochloride is sourced from PubChem (CID 22328699), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).