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

C14H26N6O — CID 102971648

Data last refreshed: (MolForge compound catalog, from PubChem)

IUPAC4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(NC)nc(N2CCCC(OC)C2)n1
InChIInChI=1S/C14H26N6O/c1-5-19(6-2)13-16-12(15-3)17-14(18-13)20-9-7-8-11(10-20)21-4/h11H,5-10H2,1-4H3,(H,15,16,17,18)
InChIKeyJZVAGZPZLYNGHS-UHFFFAOYSA-N
MW294.40 g/mol
LogP1.37
Rot. Bonds6

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

4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine (PubChem CID 102971648) has the molecular formula C14H26N6O and a molecular weight of 294.40 g/mol. Its IUPAC name is 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine
PubChem CID102971648
Molecular FormulaC14H26N6O
Molecular Weight294.40 g/mol
Exact Mass294.22
IUPAC Name4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(NC)nc(N2CCCC(OC)C2)n1
InChIInChI=1S/C14H26N6O/c1-5-19(6-2)13-16-12(15-3)17-14(18-13)20-9-7-8-11(10-20)21-4/h11H,5-10H2,1-4H3,(H,15,16,17,18)
InChIKeyJZVAGZPZLYNGHS-UHFFFAOYSA-N
XLogP1.37
TPSA66.41 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.40
LogP ≤ 51.37
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine?
The IUPAC name of 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine (CID 102971648) is 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(NC)nc(N2CCCC(OC)C2)n1.
What is the InChIKey of 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine?
The InChIKey is JZVAGZPZLYNGHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H26N6O/c1-5-19(6-2)13-16-12(15-3)17-14(18-13)20-9-7-8-11(10-20)21-4/h11H,5-10H2,1-4H3,(H,15,16,17,18).
What are the key properties of 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine?
4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine has a molecular weight of 294.40 g/mol, XLogP of 1.37, 6 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4-N,4-N-diethyl-6-(3-methoxypiperidin-1-yl)-2-N-methyl-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 102971648), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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