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

C14H20N6 — CID 115375435

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

IUPAC2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(NC)nc(-c2cncc(C)c2)n1
InChIInChI=1S/C14H20N6/c1-5-20(6-2)14-18-12(17-13(15-4)19-14)11-7-10(3)8-16-9-11/h7-9H,5-6H2,1-4H3,(H,15,17,18,19)
InChIKeyCWNBQKZMKZHYPC-UHFFFAOYSA-N
MW272.36 g/mol
LogP2.13
Rot. Bonds5

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

2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine (PubChem CID 115375435) has the molecular formula C14H20N6 and a molecular weight of 272.36 g/mol. Its IUPAC name is 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine.

Molecular Properties

Compound Name2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine
PubChem CID115375435
Molecular FormulaC14H20N6
Molecular Weight272.36 g/mol
Exact Mass272.17
IUPAC Name2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine
SMILESCCN(CC)c1nc(NC)nc(-c2cncc(C)c2)n1
InChIInChI=1S/C14H20N6/c1-5-20(6-2)14-18-12(17-13(15-4)19-14)11-7-10(3)8-16-9-11/h7-9H,5-6H2,1-4H3,(H,15,17,18,19)
InChIKeyCWNBQKZMKZHYPC-UHFFFAOYSA-N
XLogP2.13
TPSA66.83 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.36
LogP ≤ 52.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine?
The IUPAC name of 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine (CID 115375435) is 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine.
What is the SMILES notation for 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine?
The canonical SMILES for 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine is CCN(CC)c1nc(NC)nc(-c2cncc(C)c2)n1.
What is the InChIKey of 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine?
The InChIKey is CWNBQKZMKZHYPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H20N6/c1-5-20(6-2)14-18-12(17-13(15-4)19-14)11-7-10(3)8-16-9-11/h7-9H,5-6H2,1-4H3,(H,15,17,18,19).
What are the key properties of 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine?
2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine has a molecular weight of 272.36 g/mol, XLogP of 2.13, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N,2-N-diethyl-4-N-methyl-6-(5-methyl-3-pyridinyl)-1,3,5-triazine-2,4-diamine is sourced from PubChem (CID 115375435), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).

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