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

C18H25N5O — CID 89303275

IUPAC6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCOc1nc(N(CC=C)CC=C)nc(N(CC=C)CC=C)n1
InChIInChI=1S/C18H25N5O/c1-6-11-22(12-7-2)16-19-17(23(13-8-3)14-9-4)21-18(20-16)24-15-10-5/h6-10H,1-5,11-15H2
InChIKeyNXFKTJFWQLEDMM-UHFFFAOYSA-N
MW327.43 g/mol
LogP2.79
Rot. Bonds13

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

6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine (PubChem CID 89303275) has the molecular formula C18H25N5O and a molecular weight of 327.43 g/mol. Its IUPAC name is 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
PubChem CID89303275
Molecular FormulaC18H25N5O
Molecular Weight327.43 g/mol
Exact Mass327.21
IUPAC Name6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCOc1nc(N(CC=C)CC=C)nc(N(CC=C)CC=C)n1
InChIInChI=1S/C18H25N5O/c1-6-11-22(12-7-2)16-19-17(23(13-8-3)14-9-4)21-18(20-16)24-15-10-5/h6-10H,1-5,11-15H2
InChIKeyNXFKTJFWQLEDMM-UHFFFAOYSA-N
XLogP2.79
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500327.43
LogP ≤ 52.79
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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

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Related Compounds

[1,3,5]Triazine, 2-allyloxy-4,6-di(pyrrolidin-1-yl)-
CID 3238055
Cambridge id 6807868
CID 35116
6-(allyloxy)-N,N,N',N'-tetramethyl-1,3,5-triazine-2,4-diamine
CID 1819021
6-(allyloxy)-N'-ethyl-N,N-dimethyl-1,3,5-triazine-2,4-diamine
CID 2055870
2,4-Diallylamino-6-allyloxy-sym-triazine
CID 89303317
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
4,6-bis(prop-2-enoxy)-N-prop-2-enyl-1,3,5-triazin-2-amine
CID 12205823
2,4-Bis(prop-2-enoxy)-6-pyrrolidin-1-yl-1,3,5-triazine
CID 12205825
2-(4-Methylpiperazin-1-yl)-4,6-bis(prop-2-enoxy)-1,3,5-triazine
CID 20520714

Frequently Asked Questions

What is the IUPAC name of 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine (CID 89303275) is 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine is C=CCOc1nc(N(CC=C)CC=C)nc(N(CC=C)CC=C)n1.
What is the InChIKey of 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is NXFKTJFWQLEDMM-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H25N5O/c1-6-11-22(12-7-2)16-19-17(23(13-8-3)14-9-4)21-18(20-16)24-15-10-5/h6-10H,1-5,11-15H2.
What are the key properties of 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 327.43 g/mol, XLogP of 2.79, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-prop-2-enoxy-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 89303275), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).