4-methanimidoylpyridine-2-carboximidamide

C7H8N4 — CID 57062712

IUPAC4-methanimidoylpyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(/C=N/[H])ccn1
InChIInChI=1S/C7H8N4/c8-4-5-1-2-11-6(3-5)7(9)10/h1-4,8H,(H3,9,10)/b8-4+
InChIKeyRDSCQXONBAQEJU-XBXARRHUSA-N
MW148.17 g/mol
LogP0.36
Rot. Bonds2

About 4-methanimidoylpyridine-2-carboximidamide

4-methanimidoylpyridine-2-carboximidamide (PubChem CID 57062712) has the molecular formula C7H8N4 and a molecular weight of 148.17 g/mol. Its IUPAC name is 4-methanimidoylpyridine-2-carboximidamide.

Molecular Properties

Compound Name4-methanimidoylpyridine-2-carboximidamide
PubChem CID57062712
Molecular FormulaC7H8N4
Molecular Weight148.17 g/mol
Exact Mass148.07
IUPAC Name4-methanimidoylpyridine-2-carboximidamide
SMILES[H]/N=C(\N)c1cc(/C=N/[H])ccn1
InChIInChI=1S/C7H8N4/c8-4-5-1-2-11-6(3-5)7(9)10/h1-4,8H,(H3,9,10)/b8-4+
InChIKeyRDSCQXONBAQEJU-XBXARRHUSA-N
XLogP0.36
TPSA86.61 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500148.17
LogP ≤ 50.36
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

4-prop-1-enylpyridine-2-carboximidamide;hydrochloride
CID 168731037
4-(2-carbamimidoyl-4-pyridinyl)pyridine-2-carboximidamide;dihydrochloride
CID 19988643
4-(hydroxymethyl)pyridine-2-carboximidamide
CID 63882803
4-[(dimethylamino)methyl]pyridine-2-carboximidamide
CID 63880470
4-ethylsulfanylpyridine-2-carboximidamide
CID 62926350
1-(4-methanimidoyl-2-pyridinyl)azetidin-3-amine
CID 164877992
4-(3,5-dichlorophenoxy)pyridine-2-carboximidamide
CID 62925834
4-(3,4-dimethylpyrrolidin-1-yl)pyridine-2-carboximidamide
CID 79188815
4-morpholin-4-ylpyridine-2-carboximidamide
CID 62924403
4-(3-hydroxybutan-2-ylsulfanyl)pyridine-2-carboximidamide
CID 107770761
4-(pyrimidin-2-ylsulfanylmethyl)pyridine-2-carboximidamide
CID 63881655
4-[(4-methoxyphenyl)methoxymethyl]pyridine-2-carboximidamide
CID 63882445

Frequently Asked Questions

What is the IUPAC name of 4-methanimidoylpyridine-2-carboximidamide?
The IUPAC name of 4-methanimidoylpyridine-2-carboximidamide (CID 57062712) is 4-methanimidoylpyridine-2-carboximidamide.
What is the SMILES notation for 4-methanimidoylpyridine-2-carboximidamide?
The canonical SMILES for 4-methanimidoylpyridine-2-carboximidamide is [H]/N=C(\N)c1cc(/C=N/[H])ccn1.
What is the InChIKey of 4-methanimidoylpyridine-2-carboximidamide?
The InChIKey is RDSCQXONBAQEJU-XBXARRHUSA-N. The full InChI is InChI=1S/C7H8N4/c8-4-5-1-2-11-6(3-5)7(9)10/h1-4,8H,(H3,9,10)/b8-4+.
What are the key properties of 4-methanimidoylpyridine-2-carboximidamide?
4-methanimidoylpyridine-2-carboximidamide has a molecular weight of 148.17 g/mol, XLogP of 0.36, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-methanimidoylpyridine-2-carboximidamide is sourced from PubChem (CID 57062712), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).