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

C11H20N6 — CID 80764986

IUPAC2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N(C)C)nc(N2CCCCC2)n1
InChIInChI=1S/C11H20N6/c1-12-9-13-10(16(2)3)15-11(14-9)17-7-5-4-6-8-17/h4-8H2,1-3H3,(H,12,13,14,15)
InChIKeyQJPMGCATNOZGMN-UHFFFAOYSA-N
MW236.32 g/mol
LogP0.97
Rot. Bonds3

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

2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine (PubChem CID 80764986) has the molecular formula C11H20N6 and a molecular weight of 236.32 g/mol. Its IUPAC name is 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
PubChem CID80764986
Molecular FormulaC11H20N6
Molecular Weight236.32 g/mol
Exact Mass236.17
IUPAC Name2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine
SMILESCNc1nc(N(C)C)nc(N2CCCCC2)n1
InChIInChI=1S/C11H20N6/c1-12-9-13-10(16(2)3)15-11(14-9)17-7-5-4-6-8-17/h4-8H2,1-3H3,(H,12,13,14,15)
InChIKeyQJPMGCATNOZGMN-UHFFFAOYSA-N
XLogP0.97
TPSA57.18 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds3
Heavy Atoms17
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500236.32
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine (CID 80764986) is 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine is CNc1nc(N(C)C)nc(N2CCCCC2)n1.
What is the InChIKey of 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine?
The InChIKey is QJPMGCATNOZGMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N6/c1-12-9-13-10(16(2)3)15-11(14-9)17-7-5-4-6-8-17/h4-8H2,1-3H3,(H,12,13,14,15).
What are the key properties of 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine?
2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine has a molecular weight of 236.32 g/mol, XLogP of 0.97, 3 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,4-N,4-N-trimethyl-6-piperidin-1-yl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80764986), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).