2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine

C15H31FN6 — CID 122675191

IUPAC2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine
SMILESCC(CC1CNC(C)N1C(C)C)C1CC(N=NN)NCC1F
InChIInChI=1S/C15H31FN6/c1-9(2)22-11(4)18-7-12(22)5-10(3)13-6-15(20-21-17)19-8-14(13)16/h9-15,18-19H,5-8H2,1-4H3,(H2,17,20)
InChIKeyLPGCRFMKBPIEFO-UHFFFAOYSA-N
MW314.45 g/mol
LogP1.64
Rot. Bonds5

About 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine

2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine (PubChem CID 122675191) has the molecular formula C15H31FN6 and a molecular weight of 314.45 g/mol. Its IUPAC name is 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine.

Molecular Properties

Compound Name2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine
PubChem CID122675191
Molecular FormulaC15H31FN6
Molecular Weight314.45 g/mol
Exact Mass314.26
IUPAC Name2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine
SMILESCC(CC1CNC(C)N1C(C)C)C1CC(N=NN)NCC1F
InChIInChI=1S/C15H31FN6/c1-9(2)22-11(4)18-7-12(22)5-10(3)13-6-15(20-21-17)19-8-14(13)16/h9-15,18-19H,5-8H2,1-4H3,(H2,17,20)
InChIKeyLPGCRFMKBPIEFO-UHFFFAOYSA-N
XLogP1.64
TPSA78.04 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.45
LogP ≤ 51.64
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'azo_A(324)', 'substructure': 'N/A'}, {'alert_name': 'diazo_group', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine with MolForge

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

Launch Full Analysis

Related Compounds

5-Fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
CID 130280088
3-Cyclohexyl-5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
CID 138645869
(3R)-2-cyclohexyl-5-fluoro-4-(3-methylimidazolidin-4-yl)piperidin-3-amine
CID 156302576
4-(3,5-Dimethylimidazolidin-4-yl)piperidin-3-amine
CID 123591015
1-Methyl-2-(3-methylpentyl)-5-(4-methyltetrazolidin-1-yl)piperazine
CID 123869304

Frequently Asked Questions

What is the IUPAC name of 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine?
The IUPAC name of 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine (CID 122675191) is 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine.
What is the SMILES notation for 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine?
The canonical SMILES for 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine is CC(CC1CNC(C)N1C(C)C)C1CC(N=NN)NCC1F.
What is the InChIKey of 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine?
The InChIKey is LPGCRFMKBPIEFO-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H31FN6/c1-9(2)22-11(4)18-7-12(22)5-10(3)13-6-15(20-21-17)19-8-14(13)16/h9-15,18-19H,5-8H2,1-4H3,(H2,17,20).
What are the key properties of 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine?
2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine has a molecular weight of 314.45 g/mol, XLogP of 1.64, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(aminodiazenyl)-5-fluoro-4-[1-(2-methyl-3-propan-2-ylimidazolidin-4-yl)propan-2-yl]piperidine is sourced from PubChem (CID 122675191), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).