1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine

C12H21N5O2 — CID 62861936

IUPAC1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C12H21N5O2/c1-4-13-9-5-7-17(8-6-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3
InChIKeyIUSFHFZVUWKDCY-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.47
Rot. Bonds5

About 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine

1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine (PubChem CID 62861936) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine.

Molecular Properties

Compound Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine
PubChem CID62861936
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine
SMILESCCNC1CCN(c2nc(OC)nc(OC)n2)CC1
InChIInChI=1S/C12H21N5O2/c1-4-13-9-5-7-17(8-6-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3
InChIKeyIUSFHFZVUWKDCY-UHFFFAOYSA-N
XLogP0.47
TPSA72.40 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.47
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Frequently Asked Questions

What is the IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine?
The IUPAC name of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine (CID 62861936) is 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine.
What is the SMILES notation for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine?
The canonical SMILES for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine is CCNC1CCN(c2nc(OC)nc(OC)n2)CC1.
What is the InChIKey of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine?
The InChIKey is IUSFHFZVUWKDCY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-4-13-9-5-7-17(8-6-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3.
What are the key properties of 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine?
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine has a molecular weight of 267.33 g/mol, XLogP of 0.47, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N-ethylpiperidin-4-amine is sourced from PubChem (CID 62861936), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).