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

C12H21N5 — CID 135242383

IUPAC6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(C2CCCCC2)nc(N(C)C)n1
InChIInChI=1S/C12H21N5/c1-13-11-14-10(9-7-5-4-6-8-9)15-12(16-11)17(2)3/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyKMLZSVMDYXKXIQ-UHFFFAOYSA-N
MW235.33 g/mol
LogP2.03
Rot. Bonds3

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

6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 135242383) has the molecular formula C12H21N5 and a molecular weight of 235.33 g/mol. Its IUPAC name is 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
PubChem CID135242383
Molecular FormulaC12H21N5
Molecular Weight235.33 g/mol
Exact Mass235.18
IUPAC Name6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(C2CCCCC2)nc(N(C)C)n1
InChIInChI=1S/C12H21N5/c1-13-11-14-10(9-7-5-4-6-8-9)15-12(16-11)17(2)3/h9H,4-8H2,1-3H3,(H,13,14,15,16)
InChIKeyKMLZSVMDYXKXIQ-UHFFFAOYSA-N
XLogP2.03
TPSA53.94 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.33
LogP ≤ 52.03
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine (CID 135242383) is 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is CNc1nc(C2CCCCC2)nc(N(C)C)n1.
What is the InChIKey of 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is KMLZSVMDYXKXIQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5/c1-13-11-14-10(9-7-5-4-6-8-9)15-12(16-11)17(2)3/h9H,4-8H2,1-3H3,(H,13,14,15,16).
What are the key properties of 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine?
6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 235.33 g/mol, XLogP of 2.03, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-cyclohexyl-2-N,2-N,4-N-trimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 135242383), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).