N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide

C12H12N6 — CID 3442008

IUPACN'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide
SMILESCC(=NN=C(N)c1cnccn1)c1cccnc1
InChIInChI=1S/C12H12N6/c1-9(10-3-2-4-14-7-10)17-18-12(13)11-8-15-5-6-16-11/h2-8H,1H3,(H2,13,18)
InChIKeyGSMDDPGFVOKALT-UHFFFAOYSA-N
MW240.27 g/mol
LogP1.00
Rot. Bonds3

About N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide

N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide (PubChem CID 3442008) has the molecular formula C12H12N6 and a molecular weight of 240.27 g/mol. Its IUPAC name is N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide.

Molecular Properties

Compound NameN'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide
PubChem CID3442008
Molecular FormulaC12H12N6
Molecular Weight240.27 g/mol
Exact Mass240.11
IUPAC NameN'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide
SMILESCC(=NN=C(N)c1cnccn1)c1cccnc1
InChIInChI=1S/C12H12N6/c1-9(10-3-2-4-14-7-10)17-18-12(13)11-8-15-5-6-16-11/h2-8H,1H3,(H2,13,18)
InChIKeyGSMDDPGFVOKALT-UHFFFAOYSA-N
XLogP1.00
TPSA89.41 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500240.27
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

(E)-1-pyridin-3-yl-N-[(E)-1-pyridin-3-ylethylideneamino]ethanimine
CID 5405316
1-pyrazin-2-yl-2-pyridin-3-ylethane-1,2-dione
CID 57283550
N-[N-acetyl-N'-[(E)-1-pyridin-3-ylethylideneamino]carbamimidoyl]acetamide
CID 135813165
(2Z)-1,2-diphenyl-2-[(Z)-1-pyridin-3-ylethylidenehydrazinylidene]ethanone
CID 6524389
(Z)-N-[(Z)-1-pyridin-3-ylethylideneamino]fluoren-9-imine
CID 8980425
[(Z)-1-pyridin-3-ylethylideneamino]urea
CID 5355222
N'-propan-2-ylpyrazine-2-carboximidamide
CID 63181346
N'-tert-butylpyrazine-2-carboximidamide
CID 63181941
N-methoxy-1-pyridin-3-ylethanimine
CID 57395319
(Z)-1-pyridin-3-yl-N-(1,2,4-triazol-4-yl)ethanimine
CID 6081356
N'-methoxypyridine-3-carboximidamide
CID 82467799
[amino-[[amino(pyridin-3-yl)methylidene]amino]methylidene]azanium
CID 147378238

Frequently Asked Questions

What is the IUPAC name of N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide?
The IUPAC name of N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide (CID 3442008) is N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide.
What is the SMILES notation for N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide?
The canonical SMILES for N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide is CC(=NN=C(N)c1cnccn1)c1cccnc1.
What is the InChIKey of N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide?
The InChIKey is GSMDDPGFVOKALT-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H12N6/c1-9(10-3-2-4-14-7-10)17-18-12(13)11-8-15-5-6-16-11/h2-8H,1H3,(H2,13,18).
What are the key properties of N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide?
N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide has a molecular weight of 240.27 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(1-pyridin-3-ylethylideneamino)pyrazine-2-carboximidamide is sourced from PubChem (CID 3442008), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).