potassium [4-(trifluoromethyl)phenyl]carbamoylazanide

C8H6F3KN2O — CID 143489977

IUPACpotassium [4-(trifluoromethyl)phenyl]carbamoylazanide
SMILES[K+].[NH-]C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H7F3N2O.K/c9-8(10,11)5-1-3-6(4-2-5)13-7(12)14;/h1-4H,(H3,12,13,14);/q;+1/p-1
InChIKeyUQTRFNZBNDCPCK-UHFFFAOYSA-M
MW242.24 g/mol
LogP0.29
Rot. Bonds1

About potassium [4-(trifluoromethyl)phenyl]carbamoylazanide

potassium [4-(trifluoromethyl)phenyl]carbamoylazanide (PubChem CID 143489977) has the molecular formula C8H6F3KN2O and a molecular weight of 242.24 g/mol. Its IUPAC name is potassium [4-(trifluoromethyl)phenyl]carbamoylazanide.

Molecular Properties

Compound Namepotassium [4-(trifluoromethyl)phenyl]carbamoylazanide
PubChem CID143489977
Molecular FormulaC8H6F3KN2O
Molecular Weight242.24 g/mol
Exact Mass242.01
IUPAC Namepotassium [4-(trifluoromethyl)phenyl]carbamoylazanide
SMILES[K+].[NH-]C(=O)Nc1ccc(C(F)(F)F)cc1
InChIInChI=1S/C8H7F3N2O.K/c9-8(10,11)5-1-3-6(4-2-5)13-7(12)14;/h1-4H,(H3,12,13,14);/q;+1/p-1
InChIKeyUQTRFNZBNDCPCK-UHFFFAOYSA-M
XLogP0.29
TPSA52.90 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.24
LogP ≤ 50.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

molecular nitrogen;N-[4-(trifluoromethyl)phenyl]acetamide
CID 175275825
N-methyl-N'-[4-(trifluoromethyl)phenyl]oxamide
CID 44998962
[4-[4-(trifluoromethyl)phenyl]phenyl]urea
CID 11623295
2-(dimethylamino)-N-[4-(trifluoromethyl)phenyl]propanamide
CID 17496516
2-hydroxy-N-[4-(trifluoromethyl)phenyl]propanamide
CID 51108589
(2R)-2-hydroxy-N-[4-(trifluoromethyl)phenyl]propanamide
CID 94685800
(2S)-2-hydroxy-N-[4-(trifluoromethyl)phenyl]propanamide
CID 94685798
2,2,3,3,4,4,4-heptafluoro-N-[4-(trifluoromethyl)phenyl]butanamide
CID 17071374
2-(ethylamino)-2-methyl-N-[4-(trifluoromethyl)phenyl]propanamide
CID 62833542
N-(4-methylphenyl)-4-(trifluoromethyl)benzamide
CID 599447
4-[[4-(trifluoromethyl)phenyl]carbamoylamino]benzamide
CID 108896282
1-ethenyl-3-[4-(trifluoromethyl)phenyl]urea
CID 108909328

Frequently Asked Questions

What is the IUPAC name of potassium [4-(trifluoromethyl)phenyl]carbamoylazanide?
The IUPAC name of potassium [4-(trifluoromethyl)phenyl]carbamoylazanide (CID 143489977) is potassium [4-(trifluoromethyl)phenyl]carbamoylazanide.
What is the SMILES notation for potassium [4-(trifluoromethyl)phenyl]carbamoylazanide?
The canonical SMILES for potassium [4-(trifluoromethyl)phenyl]carbamoylazanide is [K+].[NH-]C(=O)Nc1ccc(C(F)(F)F)cc1.
What is the InChIKey of potassium [4-(trifluoromethyl)phenyl]carbamoylazanide?
The InChIKey is UQTRFNZBNDCPCK-UHFFFAOYSA-M. The full InChI is InChI=1S/C8H7F3N2O.K/c9-8(10,11)5-1-3-6(4-2-5)13-7(12)14;/h1-4H,(H3,12,13,14);/q;+1/p-1.
What are the key properties of potassium [4-(trifluoromethyl)phenyl]carbamoylazanide?
potassium [4-(trifluoromethyl)phenyl]carbamoylazanide has a molecular weight of 242.24 g/mol, XLogP of 0.29, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for potassium [4-(trifluoromethyl)phenyl]carbamoylazanide is sourced from PubChem (CID 143489977), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).