[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine

C12H22N6O2 — CID 80921167

IUPAC[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCCCOc1nc(NN)nc(OC2CCN(C)CC2)n1
InChIInChI=1S/C12H22N6O2/c1-3-8-19-11-14-10(17-13)15-12(16-11)20-9-4-6-18(2)7-5-9/h9H,3-8,13H2,1-2H3,(H,14,15,16,17)
InChIKeyMMELHDFSPKQHNW-UHFFFAOYSA-N
MW282.35 g/mol
LogP0.42
Rot. Bonds6

About [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine

[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine (PubChem CID 80921167) has the molecular formula C12H22N6O2 and a molecular weight of 282.35 g/mol. Its IUPAC name is [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine.

Molecular Properties

Compound Name[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
PubChem CID80921167
Molecular FormulaC12H22N6O2
Molecular Weight282.35 g/mol
Exact Mass282.18
IUPAC Name[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
SMILESCCCOc1nc(NN)nc(OC2CCN(C)CC2)n1
InChIInChI=1S/C12H22N6O2/c1-3-8-19-11-14-10(17-13)15-12(16-11)20-9-4-6-18(2)7-5-9/h9H,3-8,13H2,1-2H3,(H,14,15,16,17)
InChIKeyMMELHDFSPKQHNW-UHFFFAOYSA-N
XLogP0.42
TPSA98.42 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.35
LogP ≤ 50.42
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 108

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

(4-cyclopentyloxy-6-propoxy-1,3,5-triazin-2-yl)hydrazine
CID 80909474
[4-(3-methoxycyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80924501
[4-(3,5-dimethylcyclohexyl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80925332
4-ethoxy-6-(1-methylpiperidin-4-yl)oxy-N-propyl-1,3,5-triazin-2-amine
CID 80879716
[4-(cyclopropylmethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80912453
4-cyclobutyloxy-6-propoxy-1,3,5-triazin-2-amine
CID 80872035
[4-(3-methylbutoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80909820
[4-(3,4a,5,6,7,7a-hexahydro-2H-cyclopenta[b][1,4]oxazin-4-yl)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80900110
N-(2-cyclopropylpropan-2-yl)-4-hydrazinyl-6-propoxy-1,3,5-triazin-2-amine
CID 114112716
N-(1-ethylpiperidin-3-yl)-4-hydrazinyl-6-propoxy-1,3,5-triazin-2-amine
CID 80901082
[4-(2-propan-2-yloxyethoxy)-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80911471
[4-propoxy-6-(3,3,3-trifluoropropoxy)-1,3,5-triazin-2-yl]hydrazine
CID 82958871

Frequently Asked Questions

What is the IUPAC name of [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The IUPAC name of [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine (CID 80921167) is [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine.
What is the SMILES notation for [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The canonical SMILES for [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine is CCCOc1nc(NN)nc(OC2CCN(C)CC2)n1.
What is the InChIKey of [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
The InChIKey is MMELHDFSPKQHNW-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H22N6O2/c1-3-8-19-11-14-10(17-13)15-12(16-11)20-9-4-6-18(2)7-5-9/h9H,3-8,13H2,1-2H3,(H,14,15,16,17).
What are the key properties of [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine?
[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine has a molecular weight of 282.35 g/mol, XLogP of 0.42, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine is sourced from PubChem (CID 80921167), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).