6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

C8H15N5O — CID 18212

IUPAC6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NC(C)C)nc(OC)n1
InChIInChI=1S/C8H15N5O/c1-5(2)10-7-11-6(9-3)12-8(13-7)14-4/h5H,1-4H3,(H2,9,10,11,12,13)
InChIKeyUDLNDEWOMCYEIA-UHFFFAOYSA-N
MW197.24 g/mol
LogP0.74
Rot. Bonds4

About 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine

6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine (PubChem CID 18212) has the molecular formula C8H15N5O and a molecular weight of 197.24 g/mol. Its IUPAC name is 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
PubChem CID18212
Molecular FormulaC8H15N5O
Molecular Weight197.24 g/mol
Exact Mass197.13
IUPAC Name6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(NC(C)C)nc(OC)n1
InChIInChI=1S/C8H15N5O/c1-5(2)10-7-11-6(9-3)12-8(13-7)14-4/h5H,1-4H3,(H2,9,10,11,12,13)
InChIKeyUDLNDEWOMCYEIA-UHFFFAOYSA-N
XLogP0.74
TPSA71.96 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.24
LogP ≤ 50.74
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

Atrazine
CID 2256
Prometon
CID 4928
Propazine
CID 4937
Deethylatrazine
CID 22563
Atraton
CID 15359
Terbumeton
CID 36584
Secbumeton
CID 33443
Simeton
CID 12654
Sebuthylazine
CID 23712
1,3,5-Triazine-2,4-diamine, 6-chloro-N2-methyl-N4-(1-methylethyl)-
CID 18153
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

Frequently Asked Questions

What is the IUPAC name of 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine (CID 18212) is 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine is CNc1nc(NC(C)C)nc(OC)n1.
What is the InChIKey of 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is UDLNDEWOMCYEIA-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15N5O/c1-5(2)10-7-11-6(9-3)12-8(13-7)14-4/h5H,1-4H3,(H2,9,10,11,12,13).
What are the key properties of 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine?
6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 197.24 g/mol, XLogP of 0.74, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-4-N-methyl-2-N-propan-2-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 18212), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).