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

C13H19N7O — CID 80898353

IUPAC4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NN)nc(N(C)Cc2ccncc2)n1
InChIInChI=1S/C13H19N7O/c1-3-8-21-13-17-11(19-14)16-12(18-13)20(2)9-10-4-6-15-7-5-10/h4-7H,3,8-9,14H2,1-2H3,(H,16,17,18,19)
InChIKeyJOKZFKKXHVDHON-UHFFFAOYSA-N
MW289.34 g/mol
LogP0.98
Rot. Bonds7

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

4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 80898353) has the molecular formula C13H19N7O and a molecular weight of 289.34 g/mol. Its IUPAC name is 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID80898353
Molecular FormulaC13H19N7O
Molecular Weight289.34 g/mol
Exact Mass289.17
IUPAC Name4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine
SMILESCCCOc1nc(NN)nc(N(C)Cc2ccncc2)n1
InChIInChI=1S/C13H19N7O/c1-3-8-21-13-17-11(19-14)16-12(18-13)20(2)9-10-4-6-15-7-5-10/h4-7H,3,8-9,14H2,1-2H3,(H,16,17,18,19)
InChIKeyJOKZFKKXHVDHON-UHFFFAOYSA-N
XLogP0.98
TPSA102.08 Ų
H-Bond Donors2
H-Bond Acceptors8
Rotatable Bonds7
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'}

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Related Compounds

4-hydrazinyl-N-methyl-6-propoxy-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80899333
N-benzyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80917380
4-hydrazinyl-N-methyl-6-propoxy-N-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
CID 80924992
5-[(4-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)-methylamino]pentan-1-ol
CID 107207610
4-hydrazinyl-6-methoxy-N-methyl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 80906839
4-N-ethyl-2-N-(furan-3-ylmethyl)-2-N-methyl-6-propoxy-1,3,5-triazine-2,4-diamine
CID 80780556
4-chloro-N-methyl-N-[(4-methylphenyl)methyl]-6-propoxy-1,3,5-triazin-2-amine
CID 62868348
4-hydrazinyl-N-methyl-N-(3-methylcyclohexyl)-6-propoxy-1,3,5-triazin-2-amine
CID 80900563
4-hydrazinyl-N-methyl-N-(1-methylsulfanylbutan-2-yl)-6-propoxy-1,3,5-triazin-2-amine
CID 115988847
4-ethoxy-6-hydrazinyl-N-methyl-N-[(2-methylfuran-3-yl)methyl]-1,3,5-triazin-2-amine
CID 80895923
2-N-benzyl-6-hydrazinyl-2-N,4-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
CID 80917534
2-hydrazinyl-N,6-dimethyl-N-(pyridin-4-ylmethyl)pyrimidin-4-amine
CID 80906970

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine (CID 80898353) is 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine is CCCOc1nc(NN)nc(N(C)Cc2ccncc2)n1.
What is the InChIKey of 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is JOKZFKKXHVDHON-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H19N7O/c1-3-8-21-13-17-11(19-14)16-12(18-13)20(2)9-10-4-6-15-7-5-10/h4-7H,3,8-9,14H2,1-2H3,(H,16,17,18,19).
What are the key properties of 4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine?
4-hydrazinyl-N-methyl-6-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 289.34 g/mol, XLogP of 0.98, 7 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-propoxy-N-(pyridin-4-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 80898353), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).