4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine

C12H21N5O2 — CID 106642807

IUPAC4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(OC)nc(N(C)CC2CCCNC2)n1
InChIInChI=1S/C12H21N5O2/c1-17(8-9-5-4-6-13-7-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3
InChIKeyKOYZRGDYIZBFOP-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.32
Rot. Bonds5

About 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine

4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine (PubChem CID 106642807) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine.

Molecular Properties

Compound Name4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine
PubChem CID106642807
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC Name4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine
SMILESCOc1nc(OC)nc(N(C)CC2CCCNC2)n1
InChIInChI=1S/C12H21N5O2/c1-17(8-9-5-4-6-13-7-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3
InChIKeyKOYZRGDYIZBFOP-UHFFFAOYSA-N
XLogP0.32
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 ≤ 50.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N,5-dimethyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine
CID 106642612
5-chloro-N-methyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71642119
5-methoxy-4-[methyl(piperidin-3-ylmethyl)amino]-1H-pyrimidin-6-one
CID 136805327
N,6-dimethyl-N-(piperidin-3-ylmethyl)-[1,2,4]triazolo[1,5-a]pyridin-2-amine
CID 106642913
N-methyl-N-(piperidin-3-ylmethyl)pyrazin-2-amine;hydrochloride
CID 71642141
N,1-dimethyl-N-(piperidin-3-ylmethyl)imidazol-2-amine
CID 106642829
4-methoxy-N-(piperidin-3-ylmethyl)-N-propan-2-ylpyrimidin-2-amine
CID 106643074
N-[(3-methoxypyrazin-2-yl)methyl]-N-methyl-1-piperidin-3-ylmethanamine
CID 71642921
N-methyl-N-(piperidin-3-ylmethyl)pyridin-2-amine;hydrochloride
CID 71642131
N-methyl-N-(piperidin-3-ylmethyl)-1H-pyrrol-2-amine
CID 115209574
1-cyclohexyl-N-methyl-N-(piperidin-3-ylmethyl)methanamine;hydrochloride
CID 119930005
6-chloro-N-methyl-N-[[(3R)-piperidin-3-yl]methyl]pyrimidin-4-amine
CID 97164469

Frequently Asked Questions

What is the IUPAC name of 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine?
The IUPAC name of 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine (CID 106642807) is 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine.
What is the SMILES notation for 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine?
The canonical SMILES for 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine is COc1nc(OC)nc(N(C)CC2CCCNC2)n1.
What is the InChIKey of 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine?
The InChIKey is KOYZRGDYIZBFOP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-17(8-9-5-4-6-13-7-9)10-14-11(18-2)16-12(15-10)19-3/h9,13H,4-8H2,1-3H3.
What are the key properties of 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine?
4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine has a molecular weight of 267.33 g/mol, XLogP of 0.32, 5 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for 4,6-dimethoxy-N-methyl-N-(piperidin-3-ylmethyl)-1,3,5-triazin-2-amine is sourced from PubChem (CID 106642807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).