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

C13H27N7O — CID 80911884

IUPACN'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCC(C)Oc1nc(NN)nc(NCC(C)(C)CN(C)C)n1
InChIInChI=1S/C13H27N7O/c1-9(2)21-12-17-10(16-11(18-12)19-14)15-7-13(3,4)8-20(5)6/h9H,7-8,14H2,1-6H3,(H2,15,16,17,18,19)
InChIKeySYDJPVDNRIMTHR-UHFFFAOYSA-N
MW297.41 g/mol
LogP0.94
Rot. Bonds8

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

N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine (PubChem CID 80911884) has the molecular formula C13H27N7O and a molecular weight of 297.41 g/mol. Its IUPAC name is N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
PubChem CID80911884
Molecular FormulaC13H27N7O
Molecular Weight297.41 g/mol
Exact Mass297.23
IUPAC NameN'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine
SMILESCC(C)Oc1nc(NN)nc(NCC(C)(C)CN(C)C)n1
InChIInChI=1S/C13H27N7O/c1-9(2)21-12-17-10(16-11(18-12)19-14)15-7-13(3,4)8-20(5)6/h9H,7-8,14H2,1-6H3,(H2,15,16,17,18,19)
InChIKeySYDJPVDNRIMTHR-UHFFFAOYSA-N
XLogP0.94
TPSA101.22 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.41
LogP ≤ 50.94
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'}

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Launch Full Analysis

Related Compounds

4-hydrazinyl-6-propan-2-yloxy-N-(2,2,2-trifluoroethyl)-1,3,5-triazin-2-amine
CID 80944783
1-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]-2-methylpropan-2-ol
CID 80915056
4-hydrazinyl-N-(2-methoxyethyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80931989
N-tert-butyl-4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80920133
4-hydrazinyl-N-(3-methoxy-2-methylpropyl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80907927
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)ethane-1,2-diamine
CID 80932481
[4-(3,3-dimethylbutoxy)-6-propan-2-yloxy-1,3,5-triazin-2-yl]hydrazine
CID 80923879
4-hydrazinyl-N-methyl-N-(2-methylbutan-2-yl)-6-propan-2-yloxy-1,3,5-triazin-2-amine
CID 80912872
N',N'-diethyl-N-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)propane-1,3-diamine
CID 80938206
3,3-dimethyl-4-[[4-(methylamino)-6-propan-2-yloxy-1,3,5-triazin-2-yl]amino]butan-1-ol
CID 106149849
3-[(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)amino]propanamide
CID 80905968
N-(2,2-dimethylbutyl)-4-ethoxy-6-hydrazinyl-1,3,5-triazin-2-amine
CID 103466753

Frequently Asked Questions

What is the IUPAC name of N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The IUPAC name of N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine (CID 80911884) is N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine.
What is the SMILES notation for N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The canonical SMILES for N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine is CC(C)Oc1nc(NN)nc(NCC(C)(C)CN(C)C)n1.
What is the InChIKey of N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
The InChIKey is SYDJPVDNRIMTHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H27N7O/c1-9(2)21-12-17-10(16-11(18-12)19-14)15-7-13(3,4)8-20(5)6/h9H,7-8,14H2,1-6H3,(H2,15,16,17,18,19).
What are the key properties of N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine?
N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine has a molecular weight of 297.41 g/mol, XLogP of 0.94, 8 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(4-hydrazinyl-6-propan-2-yloxy-1,3,5-triazin-2-yl)-N,N,2,2-tetramethylpropane-1,3-diamine is sourced from PubChem (CID 80911884), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).