4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine

C10H18N6 — CID 63868172

IUPAC4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
SMILESCCc1nc(N)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C10H18N6/c1-3-8-12-9(11)14-10(13-8)16-6-4-15(2)5-7-16/h3-7H2,1-2H3,(H2,11,12,13,14)
InChIKeyOBXBPBVFJMPAFJ-UHFFFAOYSA-N
MW222.30 g/mol
LogP-0.23
Rot. Bonds2

About 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine

4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine (PubChem CID 63868172) has the molecular formula C10H18N6 and a molecular weight of 222.30 g/mol. Its IUPAC name is 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
PubChem CID63868172
Molecular FormulaC10H18N6
Molecular Weight222.30 g/mol
Exact Mass222.16
IUPAC Name4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine
SMILESCCc1nc(N)nc(N2CCN(C)CC2)n1
InChIInChI=1S/C10H18N6/c1-3-8-12-9(11)14-10(13-8)16-6-4-15(2)5-7-16/h3-7H2,1-2H3,(H2,11,12,13,14)
InChIKeyOBXBPBVFJMPAFJ-UHFFFAOYSA-N
XLogP-0.23
TPSA71.17 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.30
LogP ≤ 5-0.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine?
The IUPAC name of 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine (CID 63868172) is 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine is CCc1nc(N)nc(N2CCN(C)CC2)n1.
What is the InChIKey of 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine?
The InChIKey is OBXBPBVFJMPAFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H18N6/c1-3-8-12-9(11)14-10(13-8)16-6-4-15(2)5-7-16/h3-7H2,1-2H3,(H2,11,12,13,14).
What are the key properties of 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine?
4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine has a molecular weight of 222.30 g/mol, XLogP of -0.23, 2 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-6-(4-methylpiperazin-1-yl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 63868172), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).