4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine

C16H23N5O — CID 89303286

IUPAC4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCOc1nc(N(C)CC=C)nc(N(CC=C)CC=C)n1
InChIInChI=1S/C16H23N5O/c1-6-10-20(5)14-17-15(21(11-7-2)12-8-3)19-16(18-14)22-13-9-4/h6-9H,1-4,10-13H2,5H3
InChIKeyKEBFOPLFLRILAU-UHFFFAOYSA-N
MW301.39 g/mol
LogP2.24
Rot. Bonds11

About 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine

4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine (PubChem CID 89303286) has the molecular formula C16H23N5O and a molecular weight of 301.39 g/mol. Its IUPAC name is 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine
PubChem CID89303286
Molecular FormulaC16H23N5O
Molecular Weight301.39 g/mol
Exact Mass301.19
IUPAC Name4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCOc1nc(N(C)CC=C)nc(N(CC=C)CC=C)n1
InChIInChI=1S/C16H23N5O/c1-6-10-20(5)14-17-15(21(11-7-2)12-8-3)19-16(18-14)22-13-9-4/h6-9H,1-4,10-13H2,5H3
InChIKeyKEBFOPLFLRILAU-UHFFFAOYSA-N
XLogP2.24
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds11
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500301.39
LogP ≤ 52.24
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

Analyze 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine with MolForge

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Launch Full Analysis

Related Compounds

Cambridge id 6807868
CID 35116
6-(allyloxy)-N,N,N',N'-tetramethyl-1,3,5-triazine-2,4-diamine
CID 1819021
4-Allyloxy-6-methoxy-N,N-dimethyl-1,3,5-triazin-2-amine
CID 610855
6-(allyloxy)-N'-ethyl-N,N-dimethyl-1,3,5-triazine-2,4-diamine
CID 2055870
4-(allyloxy)-N,N-dimethyl-6-(4-morpholinyl)-1,3,5-triazin-2-amine
CID 2187729
2,4-Diallylamino-6-allyloxy-sym-triazine
CID 89303317
1,3,5-Triazine, 2-allylamino-4-ethoxy-6-dimethylamino-
CID 602118
2-Allyloxy-4-ethoxy-6-piperidin-1-yl-[1,3,5]triazine
CID 3286572
2,2'-((4,6-Bis(allyloxy)-1,3,5-triazin-2-yl)imino)bisethanol
CID 53422711
4,6-dimethoxy-N,N-bis(prop-2-enyl)-1,3,5-triazin-2-amine
CID 298162
4-(allyloxy)-N,N-dimethyl-6-(1-piperidinyl)-1,3,5-triazin-2-amine
CID 3601901
4-Methoxy-6-prop-2-enyloxy-2-pyrrolidinyl-1,3,5-triazine
CID 4020909

Frequently Asked Questions

What is the IUPAC name of 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine (CID 89303286) is 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine is C=CCOc1nc(N(C)CC=C)nc(N(CC=C)CC=C)n1.
What is the InChIKey of 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is KEBFOPLFLRILAU-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H23N5O/c1-6-10-20(5)14-17-15(21(11-7-2)12-8-3)19-16(18-14)22-13-9-4/h6-9H,1-4,10-13H2,5H3.
What are the key properties of 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 301.39 g/mol, XLogP of 2.24, 11 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N-methyl-6-prop-2-enoxy-2-N,2-N,4-N-tris(prop-2-enyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 89303286), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).