[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine

C14H26N6O — CID 80923939

IUPAC[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESCC(C)(C)CCOc1nc(NN)nc(N2CCCCC2)n1
InChIInChI=1S/C14H26N6O/c1-14(2,3)7-10-21-13-17-11(19-15)16-12(18-13)20-8-5-4-6-9-20/h4-10,15H2,1-3H3,(H,16,17,18,19)
InChIKeyAXDWOGODMYSUJR-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.96
Rot. Bonds5

About [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine

[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80923939) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
PubChem CID80923939
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
SMILESCC(C)(C)CCOc1nc(NN)nc(N2CCCCC2)n1
InChIInChI=1S/C14H26N6O/c1-14(2,3)7-10-21-13-17-11(19-15)16-12(18-13)20-8-5-4-6-9-20/h4-10,15H2,1-3H3,(H,16,17,18,19)
InChIKeyAXDWOGODMYSUJR-UHFFFAOYSA-N
XLogP1.96
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.96
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

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

N-(2,2-dimethylpropyl)-4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80899003
[4-[(E)-but-2-enoxy]-6-pyrrolidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80930831
4-(azepan-1-yl)-6-propoxy-N-propyl-1,3,5-triazin-2-amine
CID 80750532
N-ethyl-4-hydrazinyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80932196
4-(3-methoxy-3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 106668991
[4-(3,3-dimethylbutoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80923879
4-[2-(dimethylamino)ethoxy]-N-ethyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80879166
(4-cyclohexyloxy-6-piperidin-1-yl-1,3,5-triazin-2-yl)hydrazine
CID 80905831
N-methyl-4-(3-methylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80858158
[4-(oxolan-3-ylmethoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine
CID 80911950
4-ethoxy-N-ethyl-6-pyrrolidin-1-yl-1,3,5-triazin-2-amine
CID 80767228
4-hexoxy-N-methyl-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80842498

Frequently Asked Questions

What is the IUPAC name of [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine (CID 80923939) is [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine is CC(C)(C)CCOc1nc(NN)nc(N2CCCCC2)n1.
What is the InChIKey of [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is AXDWOGODMYSUJR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-14(2,3)7-10-21-13-17-11(19-15)16-12(18-13)20-8-5-4-6-9-20/h4-10,15H2,1-3H3,(H,16,17,18,19).
What are the key properties of [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine?
[4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 294.40 g/mol, XLogP of 1.96, 5 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(3,3-dimethylbutoxy)-6-piperidin-1-yl-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80923939), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).