4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine

C10H15ClN4O2 — CID 55124122

IUPAC4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine
SMILESCOc1nc(Cl)nc(N2CCOC(C)(C)C2)n1
InChIInChI=1S/C10H15ClN4O2/c1-10(2)6-15(4-5-17-10)8-12-7(11)13-9(14-8)16-3/h4-6H2,1-3H3
InChIKeyDGKCBTHODLCDIU-UHFFFAOYSA-N
MW258.71 g/mol
LogP1.15
Rot. Bonds2

About 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine

4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine (PubChem CID 55124122) has the molecular formula C10H15ClN4O2 and a molecular weight of 258.71 g/mol. Its IUPAC name is 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine.

Molecular Properties

Compound Name4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine
PubChem CID55124122
Molecular FormulaC10H15ClN4O2
Molecular Weight258.71 g/mol
Exact Mass258.09
IUPAC Name4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine
SMILESCOc1nc(Cl)nc(N2CCOC(C)(C)C2)n1
InChIInChI=1S/C10H15ClN4O2/c1-10(2)6-15(4-5-17-10)8-12-7(11)13-9(14-8)16-3/h4-6H2,1-3H3
InChIKeyDGKCBTHODLCDIU-UHFFFAOYSA-N
XLogP1.15
TPSA60.37 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.71
LogP ≤ 51.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

2-chloro-4-methoxy-6-(3-methoxy-3-methylpiperidin-1-yl)-1,3,5-triazine
CID 107394056
2-chloro-4-(3,3-difluoropyrrolidin-1-yl)-6-methoxy-1,3,5-triazine
CID 148646907
4-(4,6-dimethoxy-1,3,5-triazin-2-yl)morpholine;2,4,6-trichloro-1,3,5-triazine;hydrochloride
CID 173009515
(2R)-4-(4,6-dimethoxy-1,3,5-triazin-2-yl)-N,2-dimethylmorpholine-2-carboxamide
CID 124975153
1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-4-methylpiperidine-4-carboxylic acid
CID 63124102
4-[1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)pyrrolidin-3-yl]morpholine
CID 63171298
1-[4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-1,4-diazepan-1-yl]ethanone
CID 55124643
1-[1-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)piperidin-4-yl]ethanamine
CID 63595725
4-(2,5-dichloropyrimidin-4-yl)-2,2-dimethylmorpholine
CID 79632898
4-(2-chloro-5-methylpyrimidin-4-yl)-2,2-dimethylmorpholine
CID 79075234
2-chloro-4-methoxy-6-[4-(2,2,2-trifluoroethyl)piperazin-1-yl]-1,3,5-triazine
CID 62970401
4-[4-chloro-6-[(2-methylpropan-2-yl)oxy]-1,3,5-triazin-2-yl]morpholine
CID 62870302

Frequently Asked Questions

What is the IUPAC name of 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine?
The IUPAC name of 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine (CID 55124122) is 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine.
What is the SMILES notation for 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine?
The canonical SMILES for 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine is COc1nc(Cl)nc(N2CCOC(C)(C)C2)n1.
What is the InChIKey of 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine?
The InChIKey is DGKCBTHODLCDIU-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15ClN4O2/c1-10(2)6-15(4-5-17-10)8-12-7(11)13-9(14-8)16-3/h4-6H2,1-3H3.
What are the key properties of 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine?
4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine has a molecular weight of 258.71 g/mol, XLogP of 1.15, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-chloro-6-methoxy-1,3,5-triazin-2-yl)-2,2-dimethylmorpholine is sourced from PubChem (CID 55124122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).