6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

C13H24N6 — CID 26008530

IUPAC6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESC[C@@H]1C[C@H](C)CN(Cc2nc(N)nc(N(C)C)n2)C1
InChIInChI=1S/C13H24N6/c1-9-5-10(2)7-19(6-9)8-11-15-12(14)17-13(16-11)18(3)4/h9-10H,5-8H2,1-4H3,(H2,14,15,16,17)/t9-,10+
InChIKeyXCUJQKCZUHQRMB-AOOOYVTPSA-N
MW264.38 g/mol
LogP1.00
Rot. Bonds3

About 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine

6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (PubChem CID 26008530) has the molecular formula C13H24N6 and a molecular weight of 264.38 g/mol. Its IUPAC name is 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
PubChem CID26008530
Molecular FormulaC13H24N6
Molecular Weight264.38 g/mol
Exact Mass264.21
IUPAC Name6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine
SMILESC[C@@H]1C[C@H](C)CN(Cc2nc(N)nc(N(C)C)n2)C1
InChIInChI=1S/C13H24N6/c1-9-5-10(2)7-19(6-9)8-11-15-12(14)17-13(16-11)18(3)4/h9-10H,5-8H2,1-4H3,(H2,14,15,16,17)/t9-,10+
InChIKeyXCUJQKCZUHQRMB-AOOOYVTPSA-N
XLogP1.00
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.38
LogP ≤ 51.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-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-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine (CID 26008530) is 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is C[C@@H]1C[C@H](C)CN(Cc2nc(N)nc(N(C)C)n2)C1.
What is the InChIKey of 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is XCUJQKCZUHQRMB-AOOOYVTPSA-N. The full InChI is InChI=1S/C13H24N6/c1-9-5-10(2)7-19(6-9)8-11-15-12(14)17-13(16-11)18(3)4/h9-10H,5-8H2,1-4H3,(H2,14,15,16,17)/t9-,10+.
What are the key properties of 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine?
6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 264.38 g/mol, XLogP of 1.00, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[[(3R,5S)-3,5-dimethylpiperidin-1-yl]methyl]-2-N,2-N-dimethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 26008530), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).