3-aminopropanimidamide;hydrochloride

C3H10ClN3 — CID 154832108

IUPAC3-aminopropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)CCN
InChIInChI=1S/C3H9N3.ClH/c4-2-1-3(5)6;/h1-2,4H2,(H3,5,6);1H
InChIKeyWSLPRSXDLWNBQT-UHFFFAOYSA-N
MW123.59 g/mol
LogP-0.31
Rot. Bonds2

About 3-aminopropanimidamide;hydrochloride

3-aminopropanimidamide;hydrochloride (PubChem CID 154832108) has the molecular formula C3H10ClN3 and a molecular weight of 123.59 g/mol. Its IUPAC name is 3-aminopropanimidamide;hydrochloride.

Molecular Properties

Compound Name3-aminopropanimidamide;hydrochloride
PubChem CID154832108
Molecular FormulaC3H10ClN3
Molecular Weight123.59 g/mol
Exact Mass123.06
IUPAC Name3-aminopropanimidamide;hydrochloride
SMILESCl.[H]/N=C(\N)CCN
InChIInChI=1S/C3H9N3.ClH/c4-2-1-3(5)6;/h1-2,4H2,(H3,5,6);1H
InChIKeyWSLPRSXDLWNBQT-UHFFFAOYSA-N
XLogP-0.31
TPSA75.89 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500123.59
LogP ≤ 5-0.31
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 3-aminopropanimidamide;hydrochloride?
The IUPAC name of 3-aminopropanimidamide;hydrochloride (CID 154832108) is 3-aminopropanimidamide;hydrochloride.
What is the SMILES notation for 3-aminopropanimidamide;hydrochloride?
The canonical SMILES for 3-aminopropanimidamide;hydrochloride is Cl.[H]/N=C(\N)CCN.
What is the InChIKey of 3-aminopropanimidamide;hydrochloride?
The InChIKey is WSLPRSXDLWNBQT-UHFFFAOYSA-N. The full InChI is InChI=1S/C3H9N3.ClH/c4-2-1-3(5)6;/h1-2,4H2,(H3,5,6);1H.
What are the key properties of 3-aminopropanimidamide;hydrochloride?
3-aminopropanimidamide;hydrochloride has a molecular weight of 123.59 g/mol, XLogP of -0.31, 2 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-aminopropanimidamide;hydrochloride is sourced from PubChem (CID 154832108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).