6-(methoxymethyl)-1,3,5-triazine-2,4-diamine

C5H9N5O — CID 10844617

IUPAC6-(methoxymethyl)-1,3,5-triazine-2,4-diamine
SMILESCOCc1nc(N)nc(N)n1
InChIInChI=1S/C5H9N5O/c1-11-2-3-8-4(6)10-5(7)9-3/h2H2,1H3,(H4,6,7,8,9,10)
InChIKeyCXCHNODPVVBZCT-UHFFFAOYSA-N
MW155.16 g/mol
LogP-0.82
Rot. Bonds2

About 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine

6-(methoxymethyl)-1,3,5-triazine-2,4-diamine (PubChem CID 10844617) has the molecular formula C5H9N5O and a molecular weight of 155.16 g/mol. Its IUPAC name is 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(methoxymethyl)-1,3,5-triazine-2,4-diamine
PubChem CID10844617
Molecular FormulaC5H9N5O
Molecular Weight155.16 g/mol
Exact Mass155.08
IUPAC Name6-(methoxymethyl)-1,3,5-triazine-2,4-diamine
SMILESCOCc1nc(N)nc(N)n1
InChIInChI=1S/C5H9N5O/c1-11-2-3-8-4(6)10-5(7)9-3/h2H2,1H3,(H4,6,7,8,9,10)
InChIKeyCXCHNODPVVBZCT-UHFFFAOYSA-N
XLogP-0.82
TPSA99.94 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.16
LogP ≤ 5-0.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

2-Amino-4-methoxy-6-methyl-1,3,5-triazine
CID 15466
4-Ethoxy-6-methyl-1,3,5-triazin-2-amine
CID 77490
1,3,5-Triazin-2-amine, 4-ethoxy-6-ethyl-
CID 121205
1,3,5-Triazin-2-amine, 4-(2-methoxyethoxy)-6-methyl-
CID 3044260
(4,6-Diamino-1,3,5-triazin-2-yl)methanol
CID 10630590
6-(Dimethoxymethyl)-1,3,5-triazine-2,4-diamine
CID 129933458
(4-Amino-6-methoxy-1,3,5-triazin-2-yl)methanol
CID 180026
4-Chloro-6-(2,2,2-trifluoroethoxymethyl)-1,3,5-triazin-2-amine
CID 103213748
4-Methyl-6-(2,2,2-trifluoroethoxymethyl)-1,3,5-triazin-2-amine
CID 103476928
4-Methyl-6-(2,2,3,3-tetrafluoropropoxymethyl)-1,3,5-triazin-2-amine
CID 103476929
6-(2,2,2-Trifluoroethoxymethyl)-1,3,5-triazine-2,4-diamine
CID 104932534
6-(methoxymethyl)-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
CID 129934264

Frequently Asked Questions

What is the IUPAC name of 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine (CID 10844617) is 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine is COCc1nc(N)nc(N)n1.
What is the InChIKey of 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is CXCHNODPVVBZCT-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H9N5O/c1-11-2-3-8-4(6)10-5(7)9-3/h2H2,1H3,(H4,6,7,8,9,10).
What are the key properties of 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine?
6-(methoxymethyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 155.16 g/mol, XLogP of -0.82, 2 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(methoxymethyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 10844617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).