4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine

C13H25N7O — CID 80901771

IUPAC4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCN1CCC(Nc2nc(NN)nc(OCC)n2)CC1
InChIInChI=1S/C13H25N7O/c1-3-7-20-8-5-10(6-9-20)15-11-16-12(19-14)18-13(17-11)21-4-2/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyRBZBTXLLCKDIAQ-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.84
Rot. Bonds7

About 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine

4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine (PubChem CID 80901771) has the molecular formula C13H25N7O and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine
PubChem CID80901771
Molecular FormulaC13H25N7O
Molecular Weight295.39 g/mol
Exact Mass295.21
IUPAC Name4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine
SMILESCCCN1CCC(Nc2nc(NN)nc(OCC)n2)CC1
InChIInChI=1S/C13H25N7O/c1-3-7-20-8-5-10(6-9-20)15-11-16-12(19-14)18-13(17-11)21-4-2/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyRBZBTXLLCKDIAQ-UHFFFAOYSA-N
XLogP0.84
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500295.39
LogP ≤ 50.84
H-Bond Donors ≤ 53
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

N-(1-ethylpiperidin-3-yl)-4-hydrazinyl-6-propoxy-1,3,5-triazin-2-amine
CID 80901082
2-N-cyclohexyl-6-ethoxy-4-N-propyl-1,3,5-triazine-2,4-diamine
CID 80766247
2-N,2-N,6-N-trimethyl-4-N-(1-propylpiperidin-4-yl)-1,3,5-triazine-2,4,6-triamine
CID 80783238
5-iodo-N-(1-propylpiperidin-4-yl)pyrimidin-2-amine
CID 113459447
6-hydrazinyl-N-(1-propylpiperidin-4-yl)pyridin-2-amine
CID 80897058
6-ethoxy-4-N-ethyl-2-N-(1-methylpiperidin-3-yl)-1,3,5-triazine-2,4-diamine
CID 80798193
4-methoxy-N-(1-propylpiperidin-4-yl)pyrimidin-2-amine
CID 112683417
6-ethoxy-4-N-(furan-2-ylmethyl)-2-N-(1-methylpiperidin-4-yl)-1,3,5-triazine-2,4-diamine
CID 58039571
2-N-(4,4-dimethylcyclohexyl)-6-ethoxy-4-N-ethyl-1,3,5-triazine-2,4-diamine
CID 80823322
2-N-(4,4-dimethylcyclohexyl)-6-ethoxy-1,3,5-triazine-2,4-diamine
CID 80837854
[4-(1-methylpiperidin-4-yl)oxy-6-propoxy-1,3,5-triazin-2-yl]hydrazine
CID 80921167
[4-ethoxy-6-(3-methylpyrrolidin-1-yl)-1,3,5-triazin-2-yl]hydrazine
CID 80899195

Frequently Asked Questions

What is the IUPAC name of 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine (CID 80901771) is 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine is CCCN1CCC(Nc2nc(NN)nc(OCC)n2)CC1.
What is the InChIKey of 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine?
The InChIKey is RBZBTXLLCKDIAQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N7O/c1-3-7-20-8-5-10(6-9-20)15-11-16-12(19-14)18-13(17-11)21-4-2/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19).
What are the key properties of 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine?
4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine has a molecular weight of 295.39 g/mol, XLogP of 0.84, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethoxy-6-hydrazinyl-N-(1-propylpiperidin-4-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80901771), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).