6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine

C9H12F3N5 — CID 106775639

IUPAC6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCC1CC1Nc1cc(NN)nc(C(F)(F)F)n1
InChIInChI=1S/C9H12F3N5/c1-4-2-5(4)14-6-3-7(17-13)16-8(15-6)9(10,11)12/h3-5H,2,13H2,1H3,(H2,14,15,16,17)
InChIKeyMTDZLDZJCUPAPY-UHFFFAOYSA-N
MW247.22 g/mol
LogP1.60
Rot. Bonds3

About 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine

6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine (PubChem CID 106775639) has the molecular formula C9H12F3N5 and a molecular weight of 247.22 g/mol. Its IUPAC name is 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine
PubChem CID106775639
Molecular FormulaC9H12F3N5
Molecular Weight247.22 g/mol
Exact Mass247.10
IUPAC Name6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine
SMILESCC1CC1Nc1cc(NN)nc(C(F)(F)F)n1
InChIInChI=1S/C9H12F3N5/c1-4-2-5(4)14-6-3-7(17-13)16-8(15-6)9(10,11)12/h3-5H,2,13H2,1H3,(H2,14,15,16,17)
InChIKeyMTDZLDZJCUPAPY-UHFFFAOYSA-N
XLogP1.60
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.22
LogP ≤ 51.60
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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

6-hydrazinyl-N-(2-methylcyclopentyl)-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775688
2-hydrazinyl-N-(2-methylcyclopropyl)-6-(trifluoromethyl)pyrimidin-4-amine
CID 114567178
[6-(3,4-dimethylcyclohexyl)oxy-2-(trifluoromethyl)pyrimidin-4-yl]hydrazine
CID 106776446
6-hydrazinyl-N-[(2-methylcyclohexyl)methyl]-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775566
N-(2,6-dimethylpiperidin-1-yl)-6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106776089
2-tert-butyl-6-N-ethyl-4-N-(2-methylcyclopropyl)pyrimidine-4,6-diamine
CID 80958191
6-chloro-N-(2-methylcyclopropyl)-4-(trifluoromethyl)pyridin-2-amine
CID 102715826
4-[[6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-yl]amino]pyrrolidin-2-one
CID 114157150
N-(1-cyclopropylpyrrolidin-3-yl)-6-hydrazinyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775582
2-tert-butyl-N-(3-ethyl-2-methylcyclopentyl)-6-hydrazinylpyrimidin-4-amine
CID 80969799
4-N-(3,5-dimethylcyclohexyl)-6-N-methyl-2-(trifluoromethyl)pyrimidine-4,6-diamine
CID 106772242
6-hydrazinyl-N,N-dimethyl-2-(trifluoromethyl)pyrimidin-4-amine
CID 106775982

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine (CID 106775639) is 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine is CC1CC1Nc1cc(NN)nc(C(F)(F)F)n1.
What is the InChIKey of 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine?
The InChIKey is MTDZLDZJCUPAPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12F3N5/c1-4-2-5(4)14-6-3-7(17-13)16-8(15-6)9(10,11)12/h3-5H,2,13H2,1H3,(H2,14,15,16,17).
What are the key properties of 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine?
6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine has a molecular weight of 247.22 g/mol, XLogP of 1.60, 3 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-(2-methylcyclopropyl)-2-(trifluoromethyl)pyrimidin-4-amine is sourced from PubChem (CID 106775639), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).