6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine

C12H25N7O2 — CID 80899825

IUPAC6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCOCCCN(CCOC)c1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C12H25N7O2/c1-18(2)11-14-10(17-13)15-12(16-11)19(7-9-21-4)6-5-8-20-3/h5-9,13H2,1-4H3,(H,14,15,16,17)
InChIKeyOCBABVJHXBZFJF-UHFFFAOYSA-N
MW299.38 g/mol
LogP-0.29
Rot. Bonds10

About 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine

6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80899825) has the molecular formula C12H25N7O2 and a molecular weight of 299.38 g/mol. Its IUPAC name is 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID80899825
Molecular FormulaC12H25N7O2
Molecular Weight299.38 g/mol
Exact Mass299.21
IUPAC Name6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCOCCCN(CCOC)c1nc(NN)nc(N(C)C)n1
InChIInChI=1S/C12H25N7O2/c1-18(2)11-14-10(17-13)15-12(16-11)19(7-9-21-4)6-5-8-20-3/h5-9,13H2,1-4H3,(H,14,15,16,17)
InChIKeyOCBABVJHXBZFJF-UHFFFAOYSA-N
XLogP-0.29
TPSA101.66 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds10
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500299.38
LogP ≤ 5-0.29
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

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

2-N-ethyl-6-hydrazinyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80896663
2-N,2-N-bis(2-methoxyethyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4,6-triamine
CID 80795772
N,N-dibutyl-4,6-dihydrazinyl-1,3,5-triazin-2-amine
CID 101056119
2-N-ethyl-6-hydrazinyl-4-N,4-N-dimethyl-2-N-propyl-1,3,5-triazine-2,4-diamine
CID 80944127
4-N,4-N-diethyl-6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
CID 82943478
6-N-ethyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-2-N-(2-methylpropyl)-1,3,5-triazine-2,4,6-triamine
CID 80786638
2-[[4-(dimethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-methylamino]-N-(2-methoxyethyl)acetamide
CID 80900030
4-hydrazinyl-N-(3-methoxypropyl)-N-methyl-6-pyrazol-1-yl-1,3,5-triazin-2-amine
CID 80918881
2-N-(2-methoxyethyl)-2-N,4-N,4-N-trimethyl-6-N-propyl-1,3,5-triazine-2,4,6-triamine
CID 80795524
4-(aminomethyl)-N-(2-methoxyethyl)-N-(3-methoxypropyl)pyrimidin-2-amine
CID 107541800
4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80916617
6-hydrazinyl-4-N,4-N-dimethyl-2-N-[3-[methyl(propan-2-yl)amino]propyl]-1,3,5-triazine-2,4-diamine
CID 106043693

Frequently Asked Questions

What is the IUPAC name of 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 80899825) is 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is COCCCN(CCOC)c1nc(NN)nc(N(C)C)n1.
What is the InChIKey of 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is OCBABVJHXBZFJF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N7O2/c1-18(2)11-14-10(17-13)15-12(16-11)19(7-9-21-4)6-5-8-20-3/h5-9,13H2,1-4H3,(H,14,15,16,17).
What are the key properties of 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 299.38 g/mol, XLogP of -0.29, 10 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 6-hydrazinyl-2-N-(2-methoxyethyl)-2-N-(3-methoxypropyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80899825), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).