(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide

C10H8N6 — CID 10954852

IUPAC(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide
SMILESN#C/C(=N/Nc1ccn[nH]1)c1ccccn1
InChIInChI=1S/C10H8N6/c11-7-9(8-3-1-2-5-12-8)14-16-10-4-6-13-15-10/h1-6H,(H2,13,15,16)/b14-9-
InChIKeyHCPONGJXMUJLAC-ZROIWOOFSA-N
MW212.22 g/mol
LogP1.14
Rot. Bonds3

About (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide

(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide (PubChem CID 10954852) has the molecular formula C10H8N6 and a molecular weight of 212.22 g/mol. Its IUPAC name is (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide.

Molecular Properties

Compound Name(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide
PubChem CID10954852
Molecular FormulaC10H8N6
Molecular Weight212.22 g/mol
Exact Mass212.08
IUPAC Name(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide
SMILESN#C/C(=N/Nc1ccn[nH]1)c1ccccn1
InChIInChI=1S/C10H8N6/c11-7-9(8-3-1-2-5-12-8)14-16-10-4-6-13-15-10/h1-6H,(H2,13,15,16)/b14-9-
InChIKeyHCPONGJXMUJLAC-ZROIWOOFSA-N
XLogP1.14
TPSA89.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.22
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

4-[2-[cyano(pyridin-2-yl)methylidene]hydrazinyl]benzoic acid
CID 4092858
2-[[2-(pyridine-2-carbonyl)phenyl]hydrazinylidene]propanedinitrile
CID 169337755
5-cyano-N-(1H-pyrazol-5-yl)pyridine-2-carboxamide
CID 63718471
(E)-3-hydroxy-2-pyridin-2-ylprop-2-enenitrile
CID 136664514
3-ethoxy-2-pyridin-2-ylpent-2-enenitrile;1H-pyrazol-5-amine
CID 70984073
N-[2-(1H-pyrazol-5-yl)ethyl]pyridine-2-carboxamide
CID 110745166
(Z)-3-(4-chlorophenyl)-3-pyridin-2-ylprop-2-enenitrile
CID 122228015
N-(1-cyanocyclopropyl)pyridine-2-carboxamide
CID 160579083
3-amino-3-phenyl-2-pyridin-2-ylprop-2-enenitrile
CID 4114741
methyl N-cyanopyridine-2-carboximidate
CID 10012189
potassium;(2Z)-2-hydroxyimino-2-pyridin-2-ylacetonitrile;(2Z)-N-oxidopyridine-2-carboximidoyl cyanide;2-pyridin-2-ylacetonitrile
CID 172921830
N'-(pyridin-2-ylamino)pyridine-2-carboximidamide
CID 139161473

Frequently Asked Questions

What is the IUPAC name of (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide?
The IUPAC name of (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide (CID 10954852) is (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide.
What is the SMILES notation for (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide?
The canonical SMILES for (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide is N#C/C(=N/Nc1ccn[nH]1)c1ccccn1.
What is the InChIKey of (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide?
The InChIKey is HCPONGJXMUJLAC-ZROIWOOFSA-N. The full InChI is InChI=1S/C10H8N6/c11-7-9(8-3-1-2-5-12-8)14-16-10-4-6-13-15-10/h1-6H,(H2,13,15,16)/b14-9-.
What are the key properties of (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide?
(2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide has a molecular weight of 212.22 g/mol, XLogP of 1.14, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2E)-N-(1H-pyrazol-5-ylamino)pyridine-2-carboximidoyl cyanide is sourced from PubChem (CID 10954852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).