2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol

C17H24N6O3 — CID 2180929

IUPAC2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol
SMILESCOc1ccc(N2CCN(c3nc(NCCO)nc(OC)n3)CC2)cc1
InChIInChI=1S/C17H24N6O3/c1-25-14-5-3-13(4-6-14)22-8-10-23(11-9-22)16-19-15(18-7-12-24)20-17(21-16)26-2/h3-6,24H,7-12H2,1-2H3,(H,18,19,20,21)
InChIKeyGLSXNYINYUHHCW-UHFFFAOYSA-N
MW360.42 g/mol
LogP0.62
Rot. Bonds7

About 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol

2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol (PubChem CID 2180929) has the molecular formula C17H24N6O3 and a molecular weight of 360.42 g/mol. Its IUPAC name is 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol.

Molecular Properties

Compound Name2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol
PubChem CID2180929
Molecular FormulaC17H24N6O3
Molecular Weight360.42 g/mol
Exact Mass360.19
IUPAC Name2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol
SMILESCOc1ccc(N2CCN(c3nc(NCCO)nc(OC)n3)CC2)cc1
InChIInChI=1S/C17H24N6O3/c1-25-14-5-3-13(4-6-14)22-8-10-23(11-9-22)16-19-15(18-7-12-24)20-17(21-16)26-2/h3-6,24H,7-12H2,1-2H3,(H,18,19,20,21)
InChIKeyGLSXNYINYUHHCW-UHFFFAOYSA-N
XLogP0.62
TPSA95.87 Ų
H-Bond Donors2
H-Bond Acceptors9
Rotatable Bonds7
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500360.42
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_C(246)', 'substructure': 'N/A'}

Analyze 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol with MolForge

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Launch Full Analysis

Related Compounds

N-(3-chloro-4-methoxyphenyl)-4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-amine
CID 2901969
4-methoxy-6-morpholin-4-yl-N-propyl-1,3,5-triazin-2-amine
CID 80766525
[1-[4-methoxy-6-(propylamino)-1,3,5-triazin-2-yl]piperidin-4-yl]methanol
CID 80757527
4-methoxy-6-(4-methyl-1,4-diazepan-1-yl)-N-propyl-1,3,5-triazin-2-amine
CID 80765758
3-[[4-(azepan-1-yl)-6-methoxy-1,3,5-triazin-2-yl]amino]propanoic acid
CID 122048209
4-[4,6-bis[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]morpholine
CID 10076145
1-[4-[4-(ethylamino)-6-methoxy-1,3,5-triazin-2-yl]piperazin-1-yl]ethanone
CID 80766965
4-(1,1-dioxo-1,4-thiazinan-4-yl)-6-methoxy-N-propyl-1,3,5-triazin-2-amine
CID 80793176
4-methoxy-6-(1-oxo-1,4-thiazinan-4-yl)-N-propyl-1,3,5-triazin-2-amine
CID 80804877
2-[4-(4-methoxyphenyl)piperazin-1-yl]-6-methyl-N-propylpyrimidine-4-carboxamide
CID 109319143
2-N,2-N,4-N,4-N-tetraethyl-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazine-2,4-diamine
CID 4296013
N-[2-[[4-(azepan-1-yl)-6-methoxy-1,3,5-triazin-2-yl]amino]ethyl]furan-2-carboxamide
CID 133344695

Frequently Asked Questions

What is the IUPAC name of 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol?
The IUPAC name of 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol (CID 2180929) is 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol.
What is the SMILES notation for 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol?
The canonical SMILES for 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol is COc1ccc(N2CCN(c3nc(NCCO)nc(OC)n3)CC2)cc1.
What is the InChIKey of 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol?
The InChIKey is GLSXNYINYUHHCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N6O3/c1-25-14-5-3-13(4-6-14)22-8-10-23(11-9-22)16-19-15(18-7-12-24)20-17(21-16)26-2/h3-6,24H,7-12H2,1-2H3,(H,18,19,20,21).
What are the key properties of 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol?
2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol has a molecular weight of 360.42 g/mol, XLogP of 0.62, 7 rotatable bonds, 2 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[[4-methoxy-6-[4-(4-methoxyphenyl)piperazin-1-yl]-1,3,5-triazin-2-yl]amino]ethanol is sourced from PubChem (CID 2180929), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).