6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine

C12H19N5O — CID 89284280

IUPAC6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCN(C)c1nc(OC)nc(N(C)CC=C)n1
InChIInChI=1S/C12H19N5O/c1-6-8-16(3)10-13-11(17(4)9-7-2)15-12(14-10)18-5/h6-7H,1-2,8-9H2,3-5H3
InChIKeyVOYMHLITGCMGDY-UHFFFAOYSA-N
MW249.32 g/mol
LogP1.12
Rot. Bonds7

About 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine

6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine (PubChem CID 89284280) has the molecular formula C12H19N5O and a molecular weight of 249.32 g/mol. Its IUPAC name is 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
PubChem CID89284280
Molecular FormulaC12H19N5O
Molecular Weight249.32 g/mol
Exact Mass249.16
IUPAC Name6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
SMILESC=CCN(C)c1nc(OC)nc(N(C)CC=C)n1
InChIInChI=1S/C12H19N5O/c1-6-8-16(3)10-13-11(17(4)9-7-2)15-12(14-10)18-5/h6-7H,1-2,8-9H2,3-5H3
InChIKeyVOYMHLITGCMGDY-UHFFFAOYSA-N
XLogP1.12
TPSA54.38 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds7
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.32
LogP ≤ 51.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

Analyze 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine with MolForge

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Related Compounds

[4-Methoxy-6-(pyrrolidin-1-yl)-1,3,5-triazin-2-yl]prop-2-en-1-ylcyanamide
CID 714969
4,6-Dimethoxy-N-2-propen-1-yl-1,3,5-triazin-2-amine
CID 2056933
s-Triazine, 4-amino-2-diallylamino-6-(N,N-dimethylformamidino)-
CID 9578379
[4,6-Bis(dimethylamino)-1,3,5-triazin-2-yl]-prop-2-enylcyanamide
CID 750966
Cambridge id 5304492
CID 2056339
2-N,4-N,4-N,6-N,6-N-pentamethyl-2-N-[[methyl(prop-2-enyl)amino]methyl]-1,3,5-triazine-2,4,6-triamine
CID 375169
2-Allylamino-4-amino-6-methoxy-s-triazine
CID 459154
N,N,N',N',N'',N''-Hexaallyl-1,3,5-triazine-2,4,6-triamine
CID 76069
s-Triazine, 2-chloro-4,6-bis(diallylamino)-
CID 95021
6-fluoro-2-N,2-N,4-N,4-N-tetrakis(prop-2-enyl)-1,3,5-triazine-2,4-diamine
CID 89978266
1,3,5-Triazine, 2-allylamino-4-ethoxy-6-dimethylamino-
CID 602118
6-Chloro-4N,4N-diethyl-2N,2N-diallyl-1,3,5-triazine-2,4-diamine
CID 180009

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine (CID 89284280) is 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine is C=CCN(C)c1nc(OC)nc(N(C)CC=C)n1.
What is the InChIKey of 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is VOYMHLITGCMGDY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N5O/c1-6-8-16(3)10-13-11(17(4)9-7-2)15-12(14-10)18-5/h6-7H,1-2,8-9H2,3-5H3.
What are the key properties of 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 249.32 g/mol, XLogP of 1.12, 7 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N,4-N-dimethyl-2-N,4-N-bis(prop-2-enyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 89284280), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).