quinoline-2-carboximidamide;dihydrochloride

C10H11Cl2N3 — CID 42614305

IUPACquinoline-2-carboximidamide;dihydrochloride
SMILESCl.Cl.[H]/N=C(\N)c1ccc2ccccc2n1
InChIInChI=1S/C10H9N3.2ClH/c11-10(12)9-6-5-7-3-1-2-4-8(7)13-9;;/h1-6H,(H3,11,12);2*1H
InChIKeyDZAQBNJXZNJMKR-UHFFFAOYSA-N
MW244.13 g/mol
LogP2.36
Rot. Bonds1

About quinoline-2-carboximidamide;dihydrochloride

quinoline-2-carboximidamide;dihydrochloride (PubChem CID 42614305) has the molecular formula C10H11Cl2N3 and a molecular weight of 244.13 g/mol. Its IUPAC name is quinoline-2-carboximidamide;dihydrochloride.

Molecular Properties

Compound Namequinoline-2-carboximidamide;dihydrochloride
PubChem CID42614305
Molecular FormulaC10H11Cl2N3
Molecular Weight244.13 g/mol
Exact Mass243.03
IUPAC Namequinoline-2-carboximidamide;dihydrochloride
SMILESCl.Cl.[H]/N=C(\N)c1ccc2ccccc2n1
InChIInChI=1S/C10H9N3.2ClH/c11-10(12)9-6-5-7-3-1-2-4-8(7)13-9;;/h1-6H,(H3,11,12);2*1H
InChIKeyDZAQBNJXZNJMKR-UHFFFAOYSA-N
XLogP2.36
TPSA62.76 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.13
LogP ≤ 52.36
H-Bond Donors ≤ 52
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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Related Compounds

pyridine-2,6-dicarboximidamide
CID 23373306
8-bromoquinoline-2-carboximidamide;hydrochloride
CID 82249989
quinoline-2-carboxamide;hydrobromide
CID 141009871
ethane;6-methyl-1,5-naphthyridine-2-carboximidamide
CID 172623231
5,7-dichloroquinoline-2-carboximidamide;hydrochloride
CID 82248568
quinoline-2-carboximidoyloxycarbonylsulfanium
CID 153176893
isoquinoline-3-carboximidamide
CID 5069411
quinoline-2-carboxamide;quinoxaline
CID 159476975
5-naphthalen-2-ylsulfanylpyridine-2-carboximidamide
CID 115490136
copper;quinoline-2-carboxylic acid
CID 68537473
europium;quinoline-2-carboxylic acid
CID 87730482
2-methylquinoline;quinoline-2-carboxamide
CID 174829911

Frequently Asked Questions

What is the IUPAC name of quinoline-2-carboximidamide;dihydrochloride?
The IUPAC name of quinoline-2-carboximidamide;dihydrochloride (CID 42614305) is quinoline-2-carboximidamide;dihydrochloride.
What is the SMILES notation for quinoline-2-carboximidamide;dihydrochloride?
The canonical SMILES for quinoline-2-carboximidamide;dihydrochloride is Cl.Cl.[H]/N=C(\N)c1ccc2ccccc2n1.
What is the InChIKey of quinoline-2-carboximidamide;dihydrochloride?
The InChIKey is DZAQBNJXZNJMKR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H9N3.2ClH/c11-10(12)9-6-5-7-3-1-2-4-8(7)13-9;;/h1-6H,(H3,11,12);2*1H.
What are the key properties of quinoline-2-carboximidamide;dihydrochloride?
quinoline-2-carboximidamide;dihydrochloride has a molecular weight of 244.13 g/mol, XLogP of 2.36, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for quinoline-2-carboximidamide;dihydrochloride is sourced from PubChem (CID 42614305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).