6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine

C9H13F4N5 — CID 106294474

IUPAC6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCC(F)(F)C(F)F)n1
InChIInChI=1S/C9H13F4N5/c1-4-6(15-3-9(12,13)8(10)11)16-5(2)17-7(4)18-14/h8H,3,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyONKBWTUKSQKLCF-UHFFFAOYSA-N
MW267.23 g/mol
LogP1.69
Rot. Bonds5

About 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine

6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine (PubChem CID 106294474) has the molecular formula C9H13F4N5 and a molecular weight of 267.23 g/mol. Its IUPAC name is 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine
PubChem CID106294474
Molecular FormulaC9H13F4N5
Molecular Weight267.23 g/mol
Exact Mass267.11
IUPAC Name6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine
SMILESCc1nc(NN)c(C)c(NCC(F)(F)C(F)F)n1
InChIInChI=1S/C9H13F4N5/c1-4-6(15-3-9(12,13)8(10)11)16-5(2)17-7(4)18-14/h8H,3,14H2,1-2H3,(H2,15,16,17,18)
InChIKeyONKBWTUKSQKLCF-UHFFFAOYSA-N
XLogP1.69
TPSA75.86 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.23
LogP ≤ 51.69
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'}, {'alert_name': 'Perfluorinated_chain', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine (CID 106294474) is 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine is Cc1nc(NN)c(C)c(NCC(F)(F)C(F)F)n1.
What is the InChIKey of 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine?
The InChIKey is ONKBWTUKSQKLCF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H13F4N5/c1-4-6(15-3-9(12,13)8(10)11)16-5(2)17-7(4)18-14/h8H,3,14H2,1-2H3,(H2,15,16,17,18).
What are the key properties of 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine?
6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine has a molecular weight of 267.23 g/mol, XLogP of 1.69, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2,5-dimethyl-N-(2,2,3,3-tetrafluoropropyl)pyrimidin-4-amine is sourced from PubChem (CID 106294474), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).