(4,6-dimethoxypyrimidin-2-yl) methyl carbonate

C8H10N2O5 — CID 67674533

IUPAC(4,6-dimethoxypyrimidin-2-yl) methyl carbonate
SMILESCOC(=O)Oc1nc(OC)cc(OC)n1
InChIInChI=1S/C8H10N2O5/c1-12-5-4-6(13-2)10-7(9-5)15-8(11)14-3/h4H,1-3H3
InChIKeyMLRRKWPPROXDLS-UHFFFAOYSA-N
MW214.18 g/mol
LogP0.64
Rot. Bonds3

About (4,6-dimethoxypyrimidin-2-yl) methyl carbonate

(4,6-dimethoxypyrimidin-2-yl) methyl carbonate (PubChem CID 67674533) has the molecular formula C8H10N2O5 and a molecular weight of 214.18 g/mol. Its IUPAC name is (4,6-dimethoxypyrimidin-2-yl) methyl carbonate.

Molecular Properties

Compound Name(4,6-dimethoxypyrimidin-2-yl) methyl carbonate
PubChem CID67674533
Molecular FormulaC8H10N2O5
Molecular Weight214.18 g/mol
Exact Mass214.06
IUPAC Name(4,6-dimethoxypyrimidin-2-yl) methyl carbonate
SMILESCOC(=O)Oc1nc(OC)cc(OC)n1
InChIInChI=1S/C8H10N2O5/c1-12-5-4-6(13-2)10-7(9-5)15-8(11)14-3/h4H,1-3H3
InChIKeyMLRRKWPPROXDLS-UHFFFAOYSA-N
XLogP0.64
TPSA79.77 Ų
H-Bond Donors
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.18
LogP ≤ 50.64
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 107

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Related Compounds

methyl 3-(4,6-dimethoxypyrimidin-2-yl)oxybutanoate
CID 15676624
methyl 2-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methylpropanoate
CID 52934245
ethyl 2-(4,6-dimethoxypyrimidin-2-yl)oxy-3-methylbut-2-enoate
CID 54461614
diethyl (2R,3R)-2,3-bis[(4,6-dimethoxypyrimidin-2-yl)oxy]butanedioate
CID 11038187
2-(4,6-dimethoxypyrimidin-2-yl)oxy-2-methylpropanoic acid
CID 134110352
N-[2-chloro-6-(4,6-dimethoxypyrimidine-2-carbonyl)phenyl]acetamide
CID 67133377
methyl N-(2,6-dimethoxypyrimidin-4-yl)carbamate
CID 102191520
N-(4,6-dimethoxypyrimidin-2-yl)carbamate
CID 22648732
methyl 5-chloro-2-(4,6-dimethoxypyrimidin-2-yl)oxybenzoate
CID 1214892
1-(4,6-dimethoxypyrimidin-2-yl)oxycyclopropane-1-carboxylic acid
CID 134095968
(4-chlorophenyl)-(4,6-dimethoxypyrimidin-2-yl)methanone
CID 708347
1-(4,6-dimethoxypyrimidin-2-yl)-3-hydroxyurea
CID 134822106

Frequently Asked Questions

What is the IUPAC name of (4,6-dimethoxypyrimidin-2-yl) methyl carbonate?
The IUPAC name of (4,6-dimethoxypyrimidin-2-yl) methyl carbonate (CID 67674533) is (4,6-dimethoxypyrimidin-2-yl) methyl carbonate.
What is the SMILES notation for (4,6-dimethoxypyrimidin-2-yl) methyl carbonate?
The canonical SMILES for (4,6-dimethoxypyrimidin-2-yl) methyl carbonate is COC(=O)Oc1nc(OC)cc(OC)n1.
What is the InChIKey of (4,6-dimethoxypyrimidin-2-yl) methyl carbonate?
The InChIKey is MLRRKWPPROXDLS-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O5/c1-12-5-4-6(13-2)10-7(9-5)15-8(11)14-3/h4H,1-3H3.
What are the key properties of (4,6-dimethoxypyrimidin-2-yl) methyl carbonate?
(4,6-dimethoxypyrimidin-2-yl) methyl carbonate has a molecular weight of 214.18 g/mol, XLogP of 0.64, 3 rotatable bonds, 0 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for (4,6-dimethoxypyrimidin-2-yl) methyl carbonate is sourced from PubChem (CID 67674533), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).