2-(6-chloro-2-pyridinyl)guanidine

C6H7ClN4 — CID 130056274

IUPAC2-(6-chloro-2-pyridinyl)guanidine
SMILESNC(N)=Nc1cccc(Cl)n1
InChIInChI=1S/C6H7ClN4/c7-4-2-1-3-5(10-4)11-6(8)9/h1-3H,(H4,8,9,10,11)
InChIKeyMPPWAUQYXXZECN-UHFFFAOYSA-N
MW170.60 g/mol
LogP0.64
Rot. Bonds1

About 2-(6-chloro-2-pyridinyl)guanidine

2-(6-chloro-2-pyridinyl)guanidine (PubChem CID 130056274) has the molecular formula C6H7ClN4 and a molecular weight of 170.60 g/mol. Its IUPAC name is 2-(6-chloro-2-pyridinyl)guanidine.

Molecular Properties

Compound Name2-(6-chloro-2-pyridinyl)guanidine
PubChem CID130056274
Molecular FormulaC6H7ClN4
Molecular Weight170.60 g/mol
Exact Mass170.04
IUPAC Name2-(6-chloro-2-pyridinyl)guanidine
SMILESNC(N)=Nc1cccc(Cl)n1
InChIInChI=1S/C6H7ClN4/c7-4-2-1-3-5(10-4)11-6(8)9/h1-3H,(H4,8,9,10,11)
InChIKeyMPPWAUQYXXZECN-UHFFFAOYSA-N
XLogP0.64
TPSA77.29 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.60
LogP ≤ 50.64
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

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Related Compounds

N-(6-chloro-2-pyridinyl)-2-methylpropanimidoyl chloride
CID 135376065
2-(6-bromo-2-pyridinyl)guanidine;hydrochloride
CID 168975342
2-chloro-6-(6-chloro-2-pyridinyl)pyridine
CID 10987918
2-chloro-6-(trichloromethyl)pyridine;2-cyanoguanidine
CID 129057148
bis(2,6-dichloropyridine);palladium(2+);chloride
CID 71744970
6-chloropyridin-2-amine;ethane
CID 143370846
6-chloro-N-fluoropyridin-2-amine
CID 171556919
2-(2-chloro-6-iodophenyl)guanidine
CID 54161142
bis(6-chloro-2-pyridinyl)methanone
CID 102384352
3-[(6-chloro-2-pyridinyl)diazenyl]-1H-indol-2-ol
CID 135659249
2-(3-chloro-2-methylphenyl)guanidine
CID 45496576
2-(2-chloro-3-methylphenyl)guanidine
CID 126455748

Frequently Asked Questions

What is the IUPAC name of 2-(6-chloro-2-pyridinyl)guanidine?
The IUPAC name of 2-(6-chloro-2-pyridinyl)guanidine (CID 130056274) is 2-(6-chloro-2-pyridinyl)guanidine.
What is the SMILES notation for 2-(6-chloro-2-pyridinyl)guanidine?
The canonical SMILES for 2-(6-chloro-2-pyridinyl)guanidine is NC(N)=Nc1cccc(Cl)n1.
What is the InChIKey of 2-(6-chloro-2-pyridinyl)guanidine?
The InChIKey is MPPWAUQYXXZECN-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H7ClN4/c7-4-2-1-3-5(10-4)11-6(8)9/h1-3H,(H4,8,9,10,11).
What are the key properties of 2-(6-chloro-2-pyridinyl)guanidine?
2-(6-chloro-2-pyridinyl)guanidine has a molecular weight of 170.60 g/mol, XLogP of 0.64, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(6-chloro-2-pyridinyl)guanidine is sourced from PubChem (CID 130056274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).