4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine

C13H25N7O — CID 80904883

IUPAC4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(C)CCCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C13H25N7O/c1-10(2)4-3-5-15-11-16-12(19-14)18-13(17-11)20-6-8-21-9-7-20/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyHSAZCPMBBAFKKV-UHFFFAOYSA-N
MW295.39 g/mol
LogP0.84
Rot. Bonds7

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

4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 80904883) has the molecular formula C13H25N7O and a molecular weight of 295.39 g/mol. Its IUPAC name is 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID80904883
Molecular FormulaC13H25N7O
Molecular Weight295.39 g/mol
Exact Mass295.21
IUPAC Name4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(C)CCCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C13H25N7O/c1-10(2)4-3-5-15-11-16-12(19-14)18-13(17-11)20-6-8-21-9-7-20/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19)
InChIKeyHSAZCPMBBAFKKV-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': 'Aliphatic_long_chain', 'substructure': 'N/A'}, {'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

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Related Compounds

4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931558
4-hydrazinyl-N-(4-methylpentyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80904327
N-butyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80931737
N-ethyl-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 34253082
4-hydrazinyl-N-(2-methylsulfonylethyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80898859
N-(3,3-dimethylbutan-2-yl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 104830689
N-(2,2-dimethylbutyl)-4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 103466763
2-N-(5-methylhexyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 115327658
3-[(4-amino-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]propan-1-ol
CID 80772383
1-[[4-morpholin-4-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-2-ol
CID 80773597
2-N-(2-methoxyethyl)-4-N-methyl-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80765285
3-[[(4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]methyl]cyclobutan-1-ol
CID 80925311

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 80904883) is 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC(C)CCCNc1nc(NN)nc(N2CCOCC2)n1.
What is the InChIKey of 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is HSAZCPMBBAFKKV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H25N7O/c1-10(2)4-3-5-15-11-16-12(19-14)18-13(17-11)20-6-8-21-9-7-20/h10H,3-9,14H2,1-2H3,(H2,15,16,17,18,19).
What are the key properties of 4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-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-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80904883), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).