N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine

C9H18N6O — CID 80917120

IUPACN-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCCCCN(C)c1nc(NN)nc(OC)n1
InChIInChI=1S/C9H18N6O/c1-4-5-6-15(2)8-11-7(14-10)12-9(13-8)16-3/h4-6,10H2,1-3H3,(H,11,12,13,14)
InChIKeyQRJZCGTWCRLSDV-UHFFFAOYSA-N
MW226.28 g/mol
LogP0.40
Rot. Bonds6

About N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine

N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine (PubChem CID 80917120) has the molecular formula C9H18N6O and a molecular weight of 226.28 g/mol. Its IUPAC name is N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
PubChem CID80917120
Molecular FormulaC9H18N6O
Molecular Weight226.28 g/mol
Exact Mass226.15
IUPAC NameN-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
SMILESCCCCN(C)c1nc(NN)nc(OC)n1
InChIInChI=1S/C9H18N6O/c1-4-5-6-15(2)8-11-7(14-10)12-9(13-8)16-3/h4-6,10H2,1-3H3,(H,11,12,13,14)
InChIKeyQRJZCGTWCRLSDV-UHFFFAOYSA-N
XLogP0.40
TPSA89.19 Ų
H-Bond Donors2
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500226.28
LogP ≤ 50.40
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'}

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Launch Full Analysis

Related Compounds

4-N-butyl-2-N,2-N-diethyl-6-hydrazinyl-4-N-methyl-1,3,5-triazine-2,4-diamine
CID 80916617
5-[(4-hydrazinyl-6-propoxy-1,3,5-triazin-2-yl)-methylamino]pentan-1-ol
CID 107207610
1-[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)-methylamino]-2-methylpropan-2-ol
CID 80923595
N-benzyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80917380
4-hydrazinyl-N-methyl-6-propoxy-N-(3,3,3-trifluoropropyl)-1,3,5-triazin-2-amine
CID 80924992
2-N,2-N-dibutyl-4-N-ethyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 80753763
2-[[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]-methylamino]ethanol
CID 80771509
N-butyl-4-hydrazinyl-N-methyl-6-morpholin-4-yl-1,3,5-triazin-2-amine
CID 80916546
2-[(4-hydrazinyl-6-methoxy-1,3,5-triazin-2-yl)-propylamino]-N-methylacetamide
CID 80904852
N,N-dibutyl-4,6-dihydrazinyl-1,3,5-triazin-2-amine
CID 101056119
N-(furan-2-ylmethyl)-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80906186
4-hydrazinyl-6-methoxy-N-methyl-N-(pyridin-3-ylmethyl)-1,3,5-triazin-2-amine
CID 80906839

Frequently Asked Questions

What is the IUPAC name of N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The IUPAC name of N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine (CID 80917120) is N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine.
What is the SMILES notation for N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The canonical SMILES for N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine is CCCCN(C)c1nc(NN)nc(OC)n1.
What is the InChIKey of N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
The InChIKey is QRJZCGTWCRLSDV-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H18N6O/c1-4-5-6-15(2)8-11-7(14-10)12-9(13-8)16-3/h4-6,10H2,1-3H3,(H,11,12,13,14).
What are the key properties of N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine?
N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine has a molecular weight of 226.28 g/mol, XLogP of 0.40, 6 rotatable bonds, 2 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-butyl-4-hydrazinyl-6-methoxy-N-methyl-1,3,5-triazin-2-amine is sourced from PubChem (CID 80917120), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).