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

C12H23N7O — CID 80931558

IUPAC4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(C)CCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C12H23N7O/c1-9(2)3-4-14-10-15-11(18-13)17-12(16-10)19-5-7-20-8-6-19/h9H,3-8,13H2,1-2H3,(H2,14,15,16,17,18)
InChIKeyJXFUASONMPKKCP-UHFFFAOYSA-N
MW281.36 g/mol
LogP0.45
Rot. Bonds6

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

4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (PubChem CID 80931558) has the molecular formula C12H23N7O and a molecular weight of 281.36 g/mol. Its IUPAC name is 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
PubChem CID80931558
Molecular FormulaC12H23N7O
Molecular Weight281.36 g/mol
Exact Mass281.20
IUPAC Name4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
SMILESCC(C)CCNc1nc(NN)nc(N2CCOCC2)n1
InChIInChI=1S/C12H23N7O/c1-9(2)3-4-14-10-15-11(18-13)17-12(16-10)19-5-7-20-8-6-19/h9H,3-8,13H2,1-2H3,(H2,14,15,16,17,18)
InChIKeyJXFUASONMPKKCP-UHFFFAOYSA-N
XLogP0.45
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500281.36
LogP ≤ 50.45
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'}

Analyze 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

4-hydrazinyl-N-(4-methylpentyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80904883
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
4-hydrazinyl-N-(4-methylpentyl)-6-piperidin-1-yl-1,3,5-triazin-2-amine
CID 80904327
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-(3-methylbutyl)-6-pyrrolidin-1-yl-1,3,5-triazine-2,4-diamine
CID 80784864
4-[(4-chloro-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]butan-2-ol
CID 64913356
1-[[4-morpholin-4-yl-6-(propylamino)-1,3,5-triazin-2-yl]amino]propan-2-ol
CID 80773597
3-[[(4-hydrazinyl-6-morpholin-4-yl-1,3,5-triazin-2-yl)amino]methyl]cyclobutan-1-ol
CID 80925311
2-N-[2-[methyl(propan-2-yl)amino]ethyl]-6-morpholin-4-yl-1,3,5-triazine-2,4-diamine
CID 80803084

Frequently Asked Questions

What is the IUPAC name of 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The IUPAC name of 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine (CID 80931558) is 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The canonical SMILES for 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is CC(C)CCNc1nc(NN)nc(N2CCOCC2)n1.
What is the InChIKey of 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
The InChIKey is JXFUASONMPKKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H23N7O/c1-9(2)3-4-14-10-15-11(18-13)17-12(16-10)19-5-7-20-8-6-19/h9H,3-8,13H2,1-2H3,(H2,14,15,16,17,18).
What are the key properties of 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine?
4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine has a molecular weight of 281.36 g/mol, XLogP of 0.45, 6 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydrazinyl-N-(3-methylbutyl)-6-morpholin-4-yl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80931558), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).