fluoromethane;1H-indazole-3-carboximidamide

C9H11FN4 — CID 145043630

IUPACfluoromethane;1H-indazole-3-carboximidamide
SMILESCF.[H]/N=C(\N)c1n[nH]c2ccccc12
InChIInChI=1S/C8H8N4.CH3F/c9-8(10)7-5-3-1-2-4-6(5)11-12-7;1-2/h1-4H,(H3,9,10)(H,11,12);1H3
InChIKeyOEBZCTRJQKKCSL-UHFFFAOYSA-N
MW194.21 g/mol
LogP1.43
Rot. Bonds1

About fluoromethane;1H-indazole-3-carboximidamide

fluoromethane;1H-indazole-3-carboximidamide (PubChem CID 145043630) has the molecular formula C9H11FN4 and a molecular weight of 194.21 g/mol. Its IUPAC name is fluoromethane;1H-indazole-3-carboximidamide.

Molecular Properties

Compound Namefluoromethane;1H-indazole-3-carboximidamide
PubChem CID145043630
Molecular FormulaC9H11FN4
Molecular Weight194.21 g/mol
Exact Mass194.10
IUPAC Namefluoromethane;1H-indazole-3-carboximidamide
SMILESCF.[H]/N=C(\N)c1n[nH]c2ccccc12
InChIInChI=1S/C8H8N4.CH3F/c9-8(10)7-5-3-1-2-4-6(5)11-12-7;1-2/h1-4H,(H3,9,10)(H,11,12);1H3
InChIKeyOEBZCTRJQKKCSL-UHFFFAOYSA-N
XLogP1.43
TPSA78.55 Ų
H-Bond Donors3
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500194.21
LogP ≤ 51.43
H-Bond Donors ≤ 53
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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Related Compounds

1-(1H-indazol-3-yl)ethanone
CID 15684169
ethane;3-[(3E)-penta-1,3-dien-3-yl]-1H-indazole
CID 144593670
N-methoxy-1H-indazole-3-carboxamide
CID 60722689
1H-indazole-3-carboxamide;(1S,5R)-8-methyl-8-azabicyclo[3.2.1]octane
CID 67338966
(3-cyano-4-imino-2-oxopentyl) 1H-indazole-3-carboxylate
CID 7927625
2-(1H-indazol-3-yl)-3,3-diphenylprop-2-enamide
CID 70003465
ethyl 2-(1H-indazol-3-yl)-2-oxoacetate
CID 70319285
3-methylisoquinoline-1-carboximidamide
CID 82573405
N-(3-amino-3-oxopropyl)-1H-indazole-3-carboxamide
CID 63081541
N-(2-amino-2-oxoethyl)-N-propan-2-yl-1H-indazole-3-carboxamide
CID 60636572
N-[3-(aminomethyl)pentan-3-yl]-1H-indazole-3-carboxamide
CID 63889553
3-methylbutyl 1H-indazole-3-carboxylate
CID 46638341

Frequently Asked Questions

What is the IUPAC name of fluoromethane;1H-indazole-3-carboximidamide?
The IUPAC name of fluoromethane;1H-indazole-3-carboximidamide (CID 145043630) is fluoromethane;1H-indazole-3-carboximidamide.
What is the SMILES notation for fluoromethane;1H-indazole-3-carboximidamide?
The canonical SMILES for fluoromethane;1H-indazole-3-carboximidamide is CF.[H]/N=C(\N)c1n[nH]c2ccccc12.
What is the InChIKey of fluoromethane;1H-indazole-3-carboximidamide?
The InChIKey is OEBZCTRJQKKCSL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H8N4.CH3F/c9-8(10)7-5-3-1-2-4-6(5)11-12-7;1-2/h1-4H,(H3,9,10)(H,11,12);1H3.
What are the key properties of fluoromethane;1H-indazole-3-carboximidamide?
fluoromethane;1H-indazole-3-carboximidamide has a molecular weight of 194.21 g/mol, XLogP of 1.43, 1 rotatable bonds, 3 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for fluoromethane;1H-indazole-3-carboximidamide is sourced from PubChem (CID 145043630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).