4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine

C12H25N7 — CID 80916617

IUPAC4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCCCCN(C)c1nc(NN)nc(N(CC)CC)n1
InChIInChI=1S/C12H25N7/c1-5-8-9-18(4)11-14-10(17-13)15-12(16-11)19(6-2)7-3/h5-9,13H2,1-4H3,(H,14,15,16,17)
InChIKeyXLZKJGNXPLDYAO-UHFFFAOYSA-N
MW267.38 g/mol
LogP1.24
Rot. Bonds8

About 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine

4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 80916617) has the molecular formula C12H25N7 and a molecular weight of 267.38 g/mol. Its IUPAC name is 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID80916617
Molecular FormulaC12H25N7
Molecular Weight267.38 g/mol
Exact Mass267.22
IUPAC Name4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCCCCN(C)c1nc(NN)nc(N(CC)CC)n1
InChIInChI=1S/C12H25N7/c1-5-8-9-18(4)11-14-10(17-13)15-12(16-11)19(6-2)7-3/h5-9,13H2,1-4H3,(H,14,15,16,17)
InChIKeyXLZKJGNXPLDYAO-UHFFFAOYSA-N
XLogP1.24
TPSA83.20 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.38
LogP ≤ 51.24
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 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

4-N-butyl-6-chloro-2-N,2-N-diethyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 62870530
N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80917120
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
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]ethanol
CID 80899174
N-butyl-4-hydrazinyl-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80916546
2-N-ethyl-6-hydrazinyl-2-N-(2-methoxyethyl)-4-N,4-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 80896663
2-[[4-(diethylamino)-6-hydrazinyl-1,3,5-triazin-2-yl]-ethylamino]-N-methylacetamide
CID 80900599
4-N-(1-cyclopropylethyl)-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80906389
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-(2-amino-2,6,6-trimethylheptan-4-yl)-2-N,2-N,4-N-tributyl-4-N-methyl-1,3,5-triazine-2,4,6-triamine
CID 146641463
2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-4-N-(oxan-4-yl)-1,3,5-triazine-2,4-diamine
CID 80898529

Frequently Asked Questions

What is the IUPAC name of 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine (CID 80916617) is 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine is CCCCN(C)c1nc(NN)nc(N(CC)CC)n1.
What is the InChIKey of 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is XLZKJGNXPLDYAO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25N7/c1-5-8-9-18(4)11-14-10(17-13)15-12(16-11)19(6-2)7-3/h5-9,13H2,1-4H3,(H,14,15,16,17).
What are the key properties of 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine?
4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 267.38 g/mol, XLogP of 1.24, 8 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80916617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).