6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine

C14H26N6 — CID 80824382

IUPAC6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(N2CCC(C)(C)CC2)n1
InChIInChI=1S/C14H26N6/c1-5-19(6-2)12-16-11(15)17-13(18-12)20-9-7-14(3,4)8-10-20/h5-10H2,1-4H3,(H2,15,16,17,18)
InChIKeyNAJGGAILIZENJO-UHFFFAOYSA-N
MW278.40 g/mol
LogP1.93
Rot. Bonds4

About 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine

6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine (PubChem CID 80824382) has the molecular formula C14H26N6 and a molecular weight of 278.40 g/mol. Its IUPAC name is 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
PubChem CID80824382
Molecular FormulaC14H26N6
Molecular Weight278.40 g/mol
Exact Mass278.22
IUPAC Name6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(N)nc(N2CCC(C)(C)CC2)n1
InChIInChI=1S/C14H26N6/c1-5-19(6-2)12-16-11(15)17-13(18-12)20-9-7-14(3,4)8-10-20/h5-10H2,1-4H3,(H2,15,16,17,18)
InChIKeyNAJGGAILIZENJO-UHFFFAOYSA-N
XLogP1.93
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms20
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine (CID 80824382) is 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(N)nc(N2CCC(C)(C)CC2)n1.
What is the InChIKey of 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine?
The InChIKey is NAJGGAILIZENJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6/c1-5-19(6-2)12-16-11(15)17-13(18-12)20-9-7-14(3,4)8-10-20/h5-10H2,1-4H3,(H2,15,16,17,18).
What are the key properties of 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine?
6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine has a molecular weight of 278.40 g/mol, XLogP of 1.93, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4,4-dimethylpiperidin-1-yl)-4-N,4-N-diethyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 80824382), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).