4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine

C13H19N7O — CID 80898355

IUPAC4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(NN)nc(N(C)Cc2ccccn2)n1
InChIInChI=1S/C13H19N7O/c1-9(2)21-13-17-11(19-14)16-12(18-13)20(3)8-10-6-4-5-7-15-10/h4-7,9H,8,14H2,1-3H3,(H,16,17,18,19)
InChIKeyBJQZQJMCQUGETP-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.98
Rot. Bonds6

About 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine

4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 80898355) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID80898355
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
SMILESCC(C)Oc1nc(NN)nc(N(C)Cc2ccccn2)n1
InChIInChI=1S/C13H19N7O/c1-9(2)21-13-17-11(19-14)16-12(18-13)20(3)8-10-6-4-5-7-15-10/h4-7,9H,8,14H2,1-3H3,(H,16,17,18,19)
InChIKeyBJQZQJMCQUGETP-UHFFFAOYSA-N
XLogP0.98
TPSA102.08 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.34
LogP ≤ 50.98
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'}

Analyze 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine with MolForge

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Related Compounds

4-chloro-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 62865087
4-hydrazinyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 80943161
N-(cyclobutylmethyl)-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80918854
N-benzyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80917380
4-hydrazinyl-N-methyl-N-(3-methylbutan-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80907234
4-hydrazinyl-N-methyl-N-(2-methylbutan-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80912872
N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80894423
4-hydrazinyl-6-methoxy-N-methyl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 80906839
4-hydrazinyl-N-[(6-methyl-2-pyridinyl)methyl]-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80902613
6-hydrazinyl-N,2,5-trimethyl-N-(pyridin-2-ylmethyl)pyrimidin-4-amine
CID 80905729
6-chloro-2-N-methyl-4-N-propyl-2-N-(pyridin-2-ylmethyl)-1,3,5-triazine-2,4-diamine
CID 80786890
4-ethoxy-6-hydrazinyl-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine
CID 80943283

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine (CID 80898355) is 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine is CC(C)Oc1nc(NN)nc(N(C)Cc2ccccn2)n1.
What is the InChIKey of 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is BJQZQJMCQUGETP-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-9(2)21-13-17-11(19-14)16-12(18-13)20(3)8-10-6-4-5-7-15-10/h4-7,9H,8,14H2,1-3H3,(H,16,17,18,19).
What are the key properties of 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine?
4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 0.98, 6 rotatable bonds, 2 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-methyl-6-propan-2-yloxy-N-(pyridin-2-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80898355), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).