2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide

C10H20F3N3 — CID 65259308

IUPAC2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN(C)CC(F)(F)F
InChIInChI=1S/C10H20F3N3/c1-9(2,8(14)15)5-4-6-16(3)7-10(11,12)13/h4-7H2,1-3H3,(H3,14,15)
InChIKeyPFYBKDBBJRQSNN-UHFFFAOYSA-N
MW239.28 g/mol
LogP2.22
Rot. Bonds6

About 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide

2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide (PubChem CID 65259308) has the molecular formula C10H20F3N3 and a molecular weight of 239.28 g/mol. Its IUPAC name is 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide.

Molecular Properties

Compound Name2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide
PubChem CID65259308
Molecular FormulaC10H20F3N3
Molecular Weight239.28 g/mol
Exact Mass239.16
IUPAC Name2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide
SMILES[H]/N=C(\N)C(C)(C)CCCN(C)CC(F)(F)F
InChIInChI=1S/C10H20F3N3/c1-9(2,8(14)15)5-4-6-16(3)7-10(11,12)13/h4-7H2,1-3H3,(H3,14,15)
InChIKeyPFYBKDBBJRQSNN-UHFFFAOYSA-N
XLogP2.22
TPSA53.11 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.28
LogP ≤ 52.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}, {'alert_name': 'imine_2', 'substructure': 'N/A'}

Analyze 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide?
The IUPAC name of 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide (CID 65259308) is 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide.
What is the SMILES notation for 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide?
The canonical SMILES for 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide is [H]/N=C(\N)C(C)(C)CCCN(C)CC(F)(F)F.
What is the InChIKey of 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide?
The InChIKey is PFYBKDBBJRQSNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20F3N3/c1-9(2,8(14)15)5-4-6-16(3)7-10(11,12)13/h4-7H2,1-3H3,(H3,14,15).
What are the key properties of 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide?
2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide has a molecular weight of 239.28 g/mol, XLogP of 2.22, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2,2-dimethyl-5-[methyl(2,2,2-trifluoroethyl)amino]pentanimidamide is sourced from PubChem (CID 65259308), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).