1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide

C7H12IN5 — CID 86736541

IUPAC1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
SMILESI.NN/C(N)=N/Cc1ccccn1
InChIInChI=1S/C7H11N5.HI/c8-7(12-9)11-5-6-3-1-2-4-10-6;/h1-4H,5,9H2,(H3,8,11,12);1H
InChIKeyKJLQVIDYRZVQKT-UHFFFAOYSA-N
MW293.11 g/mol
LogP-0.02
Rot. Bonds2

About 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide

1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide (PubChem CID 86736541) has the molecular formula C7H12IN5 and a molecular weight of 293.11 g/mol. Its IUPAC name is 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide.

Molecular Properties

Compound Name1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
PubChem CID86736541
Molecular FormulaC7H12IN5
Molecular Weight293.11 g/mol
Exact Mass293.01
IUPAC Name1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
SMILESI.NN/C(N)=N/Cc1ccccn1
InChIInChI=1S/C7H11N5.HI/c8-7(12-9)11-5-6-3-1-2-4-10-6;/h1-4H,5,9H2,(H3,8,11,12);1H
InChIKeyKJLQVIDYRZVQKT-UHFFFAOYSA-N
XLogP-0.02
TPSA89.32 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.11
LogP ≤ 5-0.02
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}, {'alert_name': 'iodine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

1-phenyl-2-(pyridin-2-ylmethyl)guanidine
CID 62072214
1-(2-methylpropyl)-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
CID 110912092
1-butyl-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
CID 111023230
1-(2-methylpropyl)-2-(pyridin-2-ylmethyl)guanidine
CID 62362398
1-butyl-2-(pyridin-2-ylmethyl)guanidine
CID 111023231
N'-(pyridin-2-ylmethyl)pyridine-2-carboximidamide
CID 528154
N'-(pyridin-2-ylmethyl)-2-sulfanylethanimidamide
CID 90668643
2-(pyridin-2-ylmethyl)guanidine;sulfuric acid
CID 13371455
1-(3-phenoxyphenyl)-2-(pyridin-2-ylmethyl)guanidine;hydroiodide
CID 111597441
1-(3-nitro-2-pyridinyl)-2-(pyridin-2-ylmethyl)guanidine
CID 100575102
ethane;1-(4-methylphenyl)sulfonyl-2-(pyridin-2-ylmethyl)guanidine
CID 142134361
1-[(3R)-1-methylpyrrolidin-3-yl]-2-(pyridin-2-ylmethyl)guanidine
CID 67208588

Frequently Asked Questions

What is the IUPAC name of 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide?
The IUPAC name of 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide (CID 86736541) is 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide.
What is the SMILES notation for 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide?
The canonical SMILES for 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide is I.NN/C(N)=N/Cc1ccccn1.
What is the InChIKey of 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide?
The InChIKey is KJLQVIDYRZVQKT-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N5.HI/c8-7(12-9)11-5-6-3-1-2-4-10-6;/h1-4H,5,9H2,(H3,8,11,12);1H.
What are the key properties of 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide?
1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide has a molecular weight of 293.11 g/mol, XLogP of -0.02, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-2-(pyridin-2-ylmethyl)guanidine;hydroiodide is sourced from PubChem (CID 86736541), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).