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1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol

C11H22N6O2 — CID 106257760

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol
SMILESCOCCC(C)(O)CNc1nc(N)nc(N(C)C)n1
InChIInChI=1S/C11H22N6O2/c1-11(18,5-6-19-4)7-13-9-14-8(12)15-10(16-9)17(2)3/h18H,5-7H2,1-4H3,(H3,12,13,14,15,16)
InChIKeyBWJIMTFXNFBTLX-UHFFFAOYSA-N
MW270.34 g/mol
LogP-0.28
Rot. Bonds7

About 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol

1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol (PubChem CID 106257760) has the molecular formula C11H22N6O2 and a molecular weight of 270.34 g/mol. Its IUPAC name is 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol.

Molecular Properties

Compound Name1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol
PubChem CID106257760
Molecular FormulaC11H22N6O2
Molecular Weight270.34 g/mol
Exact Mass270.18
IUPAC Name1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol
SMILESCOCCC(C)(O)CNc1nc(N)nc(N(C)C)n1
InChIInChI=1S/C11H22N6O2/c1-11(18,5-6-19-4)7-13-9-14-8(12)15-10(16-9)17(2)3/h18H,5-7H2,1-4H3,(H3,12,13,14,15,16)
InChIKeyBWJIMTFXNFBTLX-UHFFFAOYSA-N
XLogP-0.28
TPSA109.42 Ų
H-Bond Donors3
H-Bond Acceptors8
Rotatable Bonds7
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.34
LogP ≤ 5-0.28
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 108

Analyze 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol with MolForge

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Frequently Asked Questions

What is the IUPAC name of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol?
The IUPAC name of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol (CID 106257760) is 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol.
What is the SMILES notation for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol?
The canonical SMILES for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol is COCCC(C)(O)CNc1nc(N)nc(N(C)C)n1.
What is the InChIKey of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol?
The InChIKey is BWJIMTFXNFBTLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H22N6O2/c1-11(18,5-6-19-4)7-13-9-14-8(12)15-10(16-9)17(2)3/h18H,5-7H2,1-4H3,(H3,12,13,14,15,16).
What are the key properties of 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol?
1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol has a molecular weight of 270.34 g/mol, XLogP of -0.28, 7 rotatable bonds, 3 hydrogen bond donors, and 8 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[[4-amino-6-(dimethylamino)-1,3,5-triazin-2-yl]amino]-4-methoxy-2-methylbutan-2-ol is sourced from PubChem (CID 106257760), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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