N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine

C12H25N7O — CID 80932481

IUPACN',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1nc(NN)nc(OC(C)C)n1
InChIInChI=1S/C12H25N7O/c1-5-19(6-2)8-7-14-10-15-11(18-13)17-12(16-10)20-9(3)4/h9H,5-8,13H2,1-4H3,(H2,14,15,16,17,18)
InChIKeyGMJDKYSEHLVKMQ-UHFFFAOYSA-N
MW283.38 g/mol
LogP0.70
Rot. Bonds9

About N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine

N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine (PubChem CID 80932481) has the molecular formula C12H25N7O and a molecular weight of 283.38 g/mol. Its IUPAC name is N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
PubChem CID80932481
Molecular FormulaC12H25N7O
Molecular Weight283.38 g/mol
Exact Mass283.21
IUPAC NameN',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
SMILESCCN(CC)CCNc1nc(NN)nc(OC(C)C)n1
InChIInChI=1S/C12H25N7O/c1-5-19(6-2)8-7-14-10-15-11(18-13)17-12(16-10)20-9(3)4/h9H,5-8,13H2,1-4H3,(H2,14,15,16,17,18)
InChIKeyGMJDKYSEHLVKMQ-UHFFFAOYSA-N
XLogP0.70
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.38
LogP ≤ 50.70
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 N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine with MolForge

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Launch Full Analysis

Related Compounds

N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)propane-1,3-diamine
CID 80938206
4-hydrazinyl-N-(2-methoxyethyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80931989
2-N-[2-(diethylamino)ethyl]-6-hydrazinyl-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80931722
2-N-[2-[ethyl(methyl)amino]ethyl]-6-propan-2-yloxy-1,3,5-triazine-2,4-diamine
CID 80832721
3-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]propanamide
CID 80905968
2-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]ethylurea
CID 83117573
N-butan-2-yl-N-ethyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80894423
1-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]-2-methylpropan-2-ol
CID 80915056
4-hydrazinyl-6-propan-2-yloxy-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80944783
4-hydrazinyl-N-propan-2-yl-6-propan-2-yloxy-N-propyl-1,3,5-triazin-2-amine
CID 80895085
N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
CID 80911884
N-tert-butyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80920133

Frequently Asked Questions

What is the IUPAC name of N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine?
The IUPAC name of N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine (CID 80932481) is N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine.
What is the SMILES notation for N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine?
The canonical SMILES for N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine is CCN(CC)CCNc1nc(NN)nc(OC(C)C)n1.
What is the InChIKey of N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine?
The InChIKey is GMJDKYSEHLVKMQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N7O/c1-5-19(6-2)8-7-14-10-15-11(18-13)17-12(16-10)20-9(3)4/h9H,5-8,13H2,1-4H3,(H2,14,15,16,17,18).
What are the key properties of N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine?
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine has a molecular weight of 283.38 g/mol, XLogP of 0.70, 9 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine is sourced from PubChem (CID 80932481), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).