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

C12H21N5O2 — CID 79034210

IUPACN-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(NC2CCN(C)C(C)C2)nc(OC)n1
InChIInChI=1S/C12H21N5O2/c1-8-7-9(5-6-17(8)2)13-10-14-11(18-3)16-12(15-10)19-4/h8-9H,5-7H2,1-4H3,(H,13,14,15,16)
InChIKeyTXEXPKHMCJGYDO-UHFFFAOYSA-N
MW267.33 g/mol
LogP0.78
Rot. Bonds4

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

N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine (PubChem CID 79034210) has the molecular formula C12H21N5O2 and a molecular weight of 267.33 g/mol. Its IUPAC name is N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine.

Molecular Properties

Compound NameN-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine
PubChem CID79034210
Molecular FormulaC12H21N5O2
Molecular Weight267.33 g/mol
Exact Mass267.17
IUPAC NameN-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine
SMILESCOc1nc(NC2CCN(C)C(C)C2)nc(OC)n1
InChIInChI=1S/C12H21N5O2/c1-8-7-9(5-6-17(8)2)13-10-14-11(18-3)16-12(15-10)19-4/h8-9H,5-7H2,1-4H3,(H,13,14,15,16)
InChIKeyTXEXPKHMCJGYDO-UHFFFAOYSA-N
XLogP0.78
TPSA72.40 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 ≤ 50.78
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

N-(tert-butyl)-N'-cyclohexyl-6-methoxy-1,3,5-triazine-2,4-diamine
CID 14651806
s-Triazine, 2,4-bis(ethylamino)-6-piperidino-
CID 204414
4-(1-azepanyl)-N-cyclohexyl-6-methoxy-1,3,5-triazin-2-amine
CID 831355
Ethyl 4-[(4,6-dimethoxy-1,3,5-triazin-2-yl)amino]-1-piperidinecarboxylate
CID 976805
N-(tert-butyl)-N'-ethyl-6-(1-piperidinyl)-1,3,5-triazine-2,4-diamine
CID 974634
N2,N4-diisopropyl-6-(1-piperidyl)-1,3,5-triazine-2,4-diamine
CID 7589310
N-Cyclohexyl-6-piperidin-1-yl-[1,3,5]triazine-2,4-diamine
CID 10683888
6-(1-piperidyl)-N2,N4-dipropyl-1,3,5-triazine-2,4-diamine
CID 46854064
2-{[4-(Ethylamino)-6-(piperidin-1-YL)-1,3,5-triazin-2-YL]oxy}acetonitrile
CID 1826712
N-cyclohexyl-4,6-diethoxy-1,3,5-triazin-2-amine
CID 838403
2,4-Dimethoxy-6-(piperidin-1-yl)-1,3,5-triazine
CID 816732
2-(1-Ethylpiperidin-1-ium-1-yl)-4,6-dimethoxy-1,3,5-triazine
CID 18420077

Frequently Asked Questions

What is the IUPAC name of N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The IUPAC name of N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine (CID 79034210) is N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine.
What is the SMILES notation for N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The canonical SMILES for N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine is COc1nc(NC2CCN(C)C(C)C2)nc(OC)n1.
What is the InChIKey of N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
The InChIKey is TXEXPKHMCJGYDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21N5O2/c1-8-7-9(5-6-17(8)2)13-10-14-11(18-3)16-12(15-10)19-4/h8-9H,5-7H2,1-4H3,(H,13,14,15,16).
What are the key properties of N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine?
N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine has a molecular weight of 267.33 g/mol, XLogP of 0.78, 4 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1,2-dimethylpiperidin-4-yl)-4,6-dimethoxy-1,3,5-triazin-2-amine is sourced from PubChem (CID 79034210), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).