2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide

C10H15F3N6O — CID 106775480

IUPAC2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide
SMILESCC(Nc1cc(NN)nc(C(F)(F)F)n1)C(=O)N(C)C
InChIInChI=1S/C10H15F3N6O/c1-5(8(20)19(2)3)15-6-4-7(18-14)17-9(16-6)10(11,12)13/h4-5H,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyNUAMQIZGOBRJQL-UHFFFAOYSA-N
MW292.27 g/mol
LogP0.67
Rot. Bonds4

About 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide

2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide (PubChem CID 106775480) has the molecular formula C10H15F3N6O and a molecular weight of 292.27 g/mol. Its IUPAC name is 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide.

Molecular Properties

Compound Name2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide
PubChem CID106775480
Molecular FormulaC10H15F3N6O
Molecular Weight292.27 g/mol
Exact Mass292.13
IUPAC Name2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide
SMILESCC(Nc1cc(NN)nc(C(F)(F)F)n1)C(=O)N(C)C
InChIInChI=1S/C10H15F3N6O/c1-5(8(20)19(2)3)15-6-4-7(18-14)17-9(16-6)10(11,12)13/h4-5H,14H2,1-3H3,(H2,15,16,17,18)
InChIKeyNUAMQIZGOBRJQL-UHFFFAOYSA-N
XLogP0.67
TPSA96.17 Ų
H-Bond Donors3
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.27
LogP ≤ 50.67
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

2-[(6-hydrazinyl-2-propylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80946866
2-[[6-amino-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N-ethyl-N-methylpropanamide
CID 106773392
2-[(6-amino-2-tert-butylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80960849
2-[(2-hydrazinyl-6-methylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80897678
N-(3-ethylpentan-2-yl)-6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775723
6-hydrazinyl-N-methyl-N-propan-2-yl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775973
6-hydrazinyl-N,N-dimethyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775982
3-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-2-methylsulfanylbutan-1-ol
CID 106163726
2-[[6-(propylamino)-2-(trifluoromethyl)pyrimidin-4-yl]amino]propanamide
CID 106770807
6-hydrazinyl-N-(1-pyridin-2-ylethyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775355
[6-propan-2-ylsulfanyl-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776574
2-[(6-chloro-2-propan-2-ylpyrimidin-4-yl)amino]-N,N-dimethylpropanamide
CID 80953144

Frequently Asked Questions

What is the IUPAC name of 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide?
The IUPAC name of 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide (CID 106775480) is 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide.
What is the SMILES notation for 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide?
The canonical SMILES for 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide is CC(Nc1cc(NN)nc(C(F)(F)F)n1)C(=O)N(C)C.
What is the InChIKey of 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide?
The InChIKey is NUAMQIZGOBRJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15F3N6O/c1-5(8(20)19(2)3)15-6-4-7(18-14)17-9(16-6)10(11,12)13/h4-5H,14H2,1-3H3,(H2,15,16,17,18).
What are the key properties of 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide?
2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide has a molecular weight of 292.27 g/mol, XLogP of 0.67, 4 rotatable bonds, 3 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]-N,N-dimethylpropanamide is sourced from PubChem (CID 106775480), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).