[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine

C12H21N5O2 — CID 107160419

IUPAC[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine
SMILESCOc1nc(OC)nc(N2CCC(C)(CN)CC2)n1
InChIInChI=1S/C12H21N5O2/c1-12(8-13)4-6-17(7-5-12)9-14-10(18-2)16-11(15-9)19-3/h4-8,13H2,1-3H3
InChIKeyDIDXFYYPQGKASY-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.45
Rot. Bonds4

About [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine

[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine (PubChem CID 107160419) 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)-4-methylpiperidin-4-yl]methanamine.

Molecular Properties

Compound Name[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine
PubChem CID107160419
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine
SMILESCOc1nc(OC)nc(N2CCC(C)(CN)CC2)n1
InChIInChI=1S/C12H21N5O2/c1-12(8-13)4-6-17(7-5-12)9-14-10(18-2)16-11(15-9)19-3/h4-8,13H2,1-3H3
InChIKeyDIDXFYYPQGKASY-UHFFFAOYSA-N
XLogP0.45
TPSA86.39 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 50.45
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

4-(4,4-dimethylpiperidin-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 80823660
[1-(5,6-dimethyl-1,2,4-triazin-3-yl)-4-methylpiperidin-4-yl]methanamine
CID 107160463
4-(4,4-dimethylpiperidin-1-yl)-6-methoxy-N-methyl-1,3,5-triazin-2-amine
CID 80823839
4-(3,3-dimethylpyrrolidin-1-yl)-6-methoxy-1,3,5-triazin-2-amine
CID 80854590
[4-methyl-1-(4-methyl-6-propan-2-yloxypyrimidin-2-yl)piperidin-4-yl]methanamine
CID 107160311
2,4-dimethoxy-6-(4-methylpiperidin-1-yl)-1,3,5-triazine
CID 141014855
[4-(8-azaspiro[4.5]decan-8-yl)-6-methoxy-1,3,5-triazin-2-yl]hydrazine
CID 80914000
[1-(2-methoxy-4-pyridinyl)-4-methylpiperidin-4-yl]methanamine
CID 107160457
1-[4-methoxy-6-(methylamino)-1,3,5-triazin-2-yl]-4-methylazepan-4-ol
CID 107409062
1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-4-methylpiperidine-4-carboxylic acid
CID 63124102
1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-phenylpiperidine-4-carbonitrile
CID 155975141
(4-methyl-1-thieno[2,3-d]pyrimidin-2-ylpiperidin-4-yl)methanamine
CID 114273407

Frequently Asked Questions

What is the IUPAC name of [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine?
The IUPAC name of [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine (CID 107160419) is [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine.
What is the SMILES notation for [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine?
The canonical SMILES for [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine is COc1nc(OC)nc(N2CCC(C)(CN)CC2)n1.
What is the InChIKey of [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine?
The InChIKey is DIDXFYYPQGKASY-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-12(8-13)4-6-17(7-5-12)9-14-10(18-2)16-11(15-9)19-3/h4-8,13H2,1-3H3.
What are the key properties of [1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine?
[1-(4,6-dimethoxy-1,3,5-triazin-2-yl)-4-methylpiperidin-4-yl]methanamine has a molecular weight of 267.33 g/mol, XLogP of 0.45, 4 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)-4-methylpiperidin-4-yl]methanamine is sourced from PubChem (CID 107160419), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).