N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

C12H24N6O — CID 80894423

IUPACN-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCC(C)N(CC)c1nc(NN)nc(OC(C)C)n1
InChIInChI=1S/C12H24N6O/c1-6-9(5)18(7-2)11-14-10(17-13)15-12(16-11)19-8(3)4/h8-9H,6-7,13H2,1-5H3,(H,14,15,16,17)
InChIKeyIBDPWNXXHYNXCG-UHFFFAOYSA-N
MW268.36 g/mol
LogP1.57
Rot. Bonds7

About N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine

N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (PubChem CID 80894423) has the molecular formula C12H24N6O and a molecular weight of 268.36 g/mol. Its IUPAC name is N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
PubChem CID80894423
Molecular FormulaC12H24N6O
Molecular Weight268.36 g/mol
Exact Mass268.20
IUPAC NameN-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
SMILESCCC(C)N(CC)c1nc(NN)nc(OC(C)C)n1
InChIInChI=1S/C12H24N6O/c1-6-9(5)18(7-2)11-14-10(17-13)15-12(16-11)19-8(3)4/h8-9H,6-7,13H2,1-5H3,(H,14,15,16,17)
InChIKeyIBDPWNXXHYNXCG-UHFFFAOYSA-N
XLogP1.57
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 107

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'hydrazine', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine with MolForge

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Launch Full Analysis

Related Compounds

2-N-ethyl-2-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-1-N,1-N-dimethylpropane-1,2-diamine
CID 103192575
4-hydrazinyl-N-propan-2-yl-6-propan-2-yloxy-N-propyl-1,3,5-triazin-2-amine
CID 80895085
4-hydrazinyl-N-pentyl-N-propan-2-yl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80900261
4-butan-2-yloxy-N,N-diethyl-6-hydrazinyl-1,3,5-triazin-2-amine
CID 80917408
4-hydrazinyl-N-methyl-N-(2-methylbutan-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80912872
4-hydrazinyl-N-methyl-N-(3-methylbutan-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80907234
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
CID 80932481
N,N-diethyl-4-hydrazinyl-6-(3-methylbutan-2-yloxy)-1,3,5-triazin-2-amine
CID 80922713
N-(3-ethylpentan-2-yl)-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80910560
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)propane-1,3-diamine
CID 80938206
N-(cyclobutylmethyl)-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80918854
N-cyclohexyl-4-hydrazinyl-N-methyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80927830

Frequently Asked Questions

What is the IUPAC name of N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The IUPAC name of N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine (CID 80894423) is N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is CCC(C)N(CC)c1nc(NN)nc(OC(C)C)n1.
What is the InChIKey of N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
The InChIKey is IBDPWNXXHYNXCG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H24N6O/c1-6-9(5)18(7-2)11-14-10(17-13)15-12(16-11)19-8(3)4/h8-9H,6-7,13H2,1-5H3,(H,14,15,16,17).
What are the key properties of N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine?
N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine has a molecular weight of 268.36 g/mol, XLogP of 1.57, 7 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 80894423), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).