N'-(3-methyl-2-pyridinyl)methanimidamide

C7H9N3 — CID 55281981

IUPACN'-(3-methyl-2-pyridinyl)methanimidamide
SMILESCc1cccnc1/N=C/N
InChIInChI=1S/C7H9N3/c1-6-3-2-4-9-7(6)10-5-8/h2-5H,1H3,(H2,8,9,10)
InChIKeyCIAYZVOUIAWZMB-UHFFFAOYSA-N
MW135.17 g/mol
LogP1.01
Rot. Bonds1

About N'-(3-methyl-2-pyridinyl)methanimidamide

N'-(3-methyl-2-pyridinyl)methanimidamide (PubChem CID 55281981) has the molecular formula C7H9N3 and a molecular weight of 135.17 g/mol. Its IUPAC name is N'-(3-methyl-2-pyridinyl)methanimidamide.

Molecular Properties

Compound NameN'-(3-methyl-2-pyridinyl)methanimidamide
PubChem CID55281981
Molecular FormulaC7H9N3
Molecular Weight135.17 g/mol
Exact Mass135.08
IUPAC NameN'-(3-methyl-2-pyridinyl)methanimidamide
SMILESCc1cccnc1/N=C/N
InChIInChI=1S/C7H9N3/c1-6-3-2-4-9-7(6)10-5-8/h2-5H,1H3,(H2,8,9,10)
InChIKeyCIAYZVOUIAWZMB-UHFFFAOYSA-N
XLogP1.01
TPSA51.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500135.17
LogP ≤ 51.01
H-Bond Donors ≤ 51
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 N'-(3-methyl-2-pyridinyl)methanimidamide?
The IUPAC name of N'-(3-methyl-2-pyridinyl)methanimidamide (CID 55281981) is N'-(3-methyl-2-pyridinyl)methanimidamide.
What is the SMILES notation for N'-(3-methyl-2-pyridinyl)methanimidamide?
The canonical SMILES for N'-(3-methyl-2-pyridinyl)methanimidamide is Cc1cccnc1/N=C/N.
What is the InChIKey of N'-(3-methyl-2-pyridinyl)methanimidamide?
The InChIKey is CIAYZVOUIAWZMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H9N3/c1-6-3-2-4-9-7(6)10-5-8/h2-5H,1H3,(H2,8,9,10).
What are the key properties of N'-(3-methyl-2-pyridinyl)methanimidamide?
N'-(3-methyl-2-pyridinyl)methanimidamide has a molecular weight of 135.17 g/mol, XLogP of 1.01, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(3-methyl-2-pyridinyl)methanimidamide is sourced from PubChem (CID 55281981), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).