6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine

C10H17N5 — CID 67217441

IUPAC6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(C2CCCCC2)n1
InChIInChI=1S/C10H17N5/c1-12-10-14-8(13-9(11)15-10)7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H3,11,12,13,14,15)
InChIKeyXZTNEDZPHXYCDG-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.54
Rot. Bonds2

About 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine

6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 67217441) has the molecular formula C10H17N5 and a molecular weight of 207.28 g/mol. Its IUPAC name is 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID67217441
Molecular FormulaC10H17N5
Molecular Weight207.28 g/mol
Exact Mass207.15
IUPAC Name6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N)nc(C2CCCCC2)n1
InChIInChI=1S/C10H17N5/c1-12-10-14-8(13-9(11)15-10)7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H3,11,12,13,14,15)
InChIKeyXZTNEDZPHXYCDG-UHFFFAOYSA-N
XLogP1.54
TPSA76.72 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine (CID 67217441) is 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine is CNc1nc(N)nc(C2CCCCC2)n1.
What is the InChIKey of 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is XZTNEDZPHXYCDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H17N5/c1-12-10-14-8(13-9(11)15-10)7-5-3-2-4-6-7/h7H,2-6H2,1H3,(H3,11,12,13,14,15).
What are the key properties of 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine?
6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 207.28 g/mol, XLogP of 1.54, 2 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-2-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 67217441), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).