2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

C10H22N8O — CID 3125281

IUPAC2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NC(C)C)nc(NC(N)NOC)n1
InChIInChI=1S/C10H22N8O/c1-5-12-8-15-9(13-6(2)3)17-10(16-8)14-7(11)18-19-4/h6-7,18H,5,11H2,1-4H3,(H3,12,13,14,15,16,17)
InChIKeyCXGUWRWGRWRCKK-UHFFFAOYSA-N
MW270.34 g/mol
LogP-0.07
Rot. Bonds8

About 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine

2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (PubChem CID 3125281) has the molecular formula C10H22N8O and a molecular weight of 270.34 g/mol. Its IUPAC name is 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.

Molecular Properties

Compound Name2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
PubChem CID3125281
Molecular FormulaC10H22N8O
Molecular Weight270.34 g/mol
Exact Mass270.19
IUPAC Name2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine
SMILESCCNc1nc(NC(C)C)nc(NC(N)NOC)n1
InChIInChI=1S/C10H22N8O/c1-5-12-8-15-9(13-6(2)3)17-10(16-8)14-7(11)18-19-4/h6-7,18H,5,11H2,1-4H3,(H3,12,13,14,15,16,17)
InChIKeyCXGUWRWGRWRCKK-UHFFFAOYSA-N
XLogP-0.07
TPSA122.04 Ų
H-Bond Donors5
H-Bond Acceptors9
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 5-0.07
H-Bond Donors ≤ 55
H-Bond Acceptors ≤ 109

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'alert_name': 'Oxygen-nitrogen_single_bond', 'substructure': 'N/A'}

Analyze 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

Prometon
CID 4928
Propazine
CID 4937
Atraton
CID 15359
Terbumeton
CID 36584
Secbumeton
CID 33443
Simeton
CID 12654
N-(4,6-Bis((1-methylethyl)amino)-1,3,5-triazin-2-yl)-N-methylcyanamide
CID 49968
6-ethoxy-N2-ethyl-N4-(propan-2-yl)-1,3,5-triazine-2,4-diamine
CID 779529
N-(butan-2-yl)-N'-ethyl-6-[(propan-2-ylideneamino)oxy]-1,3,5-triazine-2,4-diamine
CID 3098377
6-Methoxy-N2-methyl-N4-(1-methylethyl)-1,3,5-triazine-2,4-diamine
CID 18212
Amino[4,6-bis(ethylamino)(1,3,5-triazin-2-yl)](methylethyl)carbonitrile
CID 826227
(4-Ethylamino-6-isopropylamino-[1,3,5]triazin-2-yl)-methyl-cyanamide
CID 910908

Frequently Asked Questions

What is the IUPAC name of 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The IUPAC name of 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine (CID 3125281) is 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine.
What is the SMILES notation for 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The canonical SMILES for 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is CCNc1nc(NC(C)C)nc(NC(N)NOC)n1.
What is the InChIKey of 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
The InChIKey is CXGUWRWGRWRCKK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N8O/c1-5-12-8-15-9(13-6(2)3)17-10(16-8)14-7(11)18-19-4/h6-7,18H,5,11H2,1-4H3,(H3,12,13,14,15,16,17).
What are the key properties of 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine?
2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine has a molecular weight of 270.34 g/mol, XLogP of -0.07, 8 rotatable bonds, 5 hydrogen bond donors, and 9 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-[amino-(methoxyamino)methyl]-6-N-ethyl-4-N-propan-2-yl-1,3,5-triazine-2,4,6-triamine is sourced from PubChem (CID 3125281), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).