6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

C6H11N5O — CID 793255

IUPAC6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(N(C)C)n1
InChIInChI=1S/C6H11N5O/c1-11(2)5-8-4(7)9-6(10-5)12-3/h1-3H3,(H2,7,8,9,10)
InChIKeyCWGBAMKHDKOACR-UHFFFAOYSA-N
MW169.19 g/mol
LogP-0.47
Rot. Bonds2

About 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 793255) has the molecular formula C6H11N5O and a molecular weight of 169.19 g/mol. Its IUPAC name is 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID793255
Molecular FormulaC6H11N5O
Molecular Weight169.19 g/mol
Exact Mass169.10
IUPAC Name6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESCOc1nc(N)nc(N(C)C)n1
InChIInChI=1S/C6H11N5O/c1-11(2)5-8-4(7)9-6(10-5)12-3/h1-3H3,(H2,7,8,9,10)
InChIKeyCWGBAMKHDKOACR-UHFFFAOYSA-N
XLogP-0.47
TPSA77.16 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500169.19
LogP ≤ 5-0.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 793255) is 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is COc1nc(N)nc(N(C)C)n1.
What is the InChIKey of 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is CWGBAMKHDKOACR-UHFFFAOYSA-N. The full InChI is InChI=1S/C6H11N5O/c1-11(2)5-8-4(7)9-6(10-5)12-3/h1-3H3,(H2,7,8,9,10).
What are the key properties of 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 169.19 g/mol, XLogP of -0.47, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methoxy-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 793255), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).