6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine

C10H16F3N5 — CID 80947335

IUPAC6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
SMILESCCCc1nc(NN)cc(N(C)CC(F)(F)F)n1
InChIInChI=1S/C10H16F3N5/c1-3-4-7-15-8(17-14)5-9(16-7)18(2)6-10(11,12)13/h5H,3-4,6,14H2,1-2H3,(H,15,16,17)
InChIKeyHHKDCTVTQCOBKN-UHFFFAOYSA-N
MW263.27 g/mol
LogP1.71
Rot. Bonds5

About 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine

6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine (PubChem CID 80947335) has the molecular formula C10H16F3N5 and a molecular weight of 263.27 g/mol. Its IUPAC name is 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
PubChem CID80947335
Molecular FormulaC10H16F3N5
Molecular Weight263.27 g/mol
Exact Mass263.14
IUPAC Name6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine
SMILESCCCc1nc(NN)cc(N(C)CC(F)(F)F)n1
InChIInChI=1S/C10H16F3N5/c1-3-4-7-15-8(17-14)5-9(16-7)18(2)6-10(11,12)13/h5H,3-4,6,14H2,1-2H3,(H,15,16,17)
InChIKeyHHKDCTVTQCOBKN-UHFFFAOYSA-N
XLogP1.71
TPSA67.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.27
LogP ≤ 51.71
H-Bond Donors ≤ 52
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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Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine?
The IUPAC name of 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine (CID 80947335) is 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine.
What is the SMILES notation for 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine?
The canonical SMILES for 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine is CCCc1nc(NN)cc(N(C)CC(F)(F)F)n1.
What is the InChIKey of 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine?
The InChIKey is HHKDCTVTQCOBKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16F3N5/c1-3-4-7-15-8(17-14)5-9(16-7)18(2)6-10(11,12)13/h5H,3-4,6,14H2,1-2H3,(H,15,16,17).
What are the key properties of 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine?
6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine has a molecular weight of 263.27 g/mol, XLogP of 1.71, 5 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-N-methyl-2-propyl-N-(2,2,2-trifluoroethyl)pyrimidin-4-amine is sourced from PubChem (CID 80947335), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).