methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate

C7H10N4O4 — CID 12803256

IUPACmethyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate
SMILESCOC(=O)Nc1nc(OC)nc(OC)n1
InChIInChI=1S/C7H10N4O4/c1-13-5-8-4(10-7(12)15-3)9-6(11-5)14-2/h1-3H3,(H,8,9,10,11,12)
InChIKeyRLVKLOFHIMTEHE-UHFFFAOYSA-N
MW214.18 g/mol
LogP0.07
Rot. Bonds3

About methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate

methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate (PubChem CID 12803256) has the molecular formula C7H10N4O4 and a molecular weight of 214.18 g/mol. Its IUPAC name is methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate.

Molecular Properties

Compound Namemethyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate
PubChem CID12803256
Molecular FormulaC7H10N4O4
Molecular Weight214.18 g/mol
Exact Mass214.07
IUPAC Namemethyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate
SMILESCOC(=O)Nc1nc(OC)nc(OC)n1
InChIInChI=1S/C7H10N4O4/c1-13-5-8-4(10-7(12)15-3)9-6(11-5)14-2/h1-3H3,(H,8,9,10,11,12)
InChIKeyRLVKLOFHIMTEHE-UHFFFAOYSA-N
XLogP0.07
TPSA95.46 Ų
H-Bond Donors1
H-Bond Acceptors7
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.18
LogP ≤ 50.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 107

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Related Compounds

Trimethoxymethylmelamine
CID 21189409
ethyl N-[4,6-bis(ethoxycarbonylamino)-1,3,5-triazin-2-yl]carbamate
CID 11142409
methyl N-(4,6-dichloro-1,3,5-triazin-2-yl)carbamate
CID 12803245
ethyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate
CID 12803257
methyl N-[4,6-bis(methoxycarbonylamino)-1,3,5-triazin-2-yl]carbamate
CID 15906617
(4,6-Dimethoxy-1,3,5-triazin-2-yl)carbamic acid
CID 18947511
[4,6-Bis(carboxyamino)-1,3,5-triazin-2-yl]carbamic acid
CID 21202880
(4,6-Dimethoxy-1,3,5-triazin-2-yl)urea
CID 21719995
Sodium;dimethyl carbonate;methanolate;1,3,5-triazine-2,4,6-triamine
CID 23679923
2-N-[dimethoxy(methylperoxy)methyl]-1,3,5-triazine-2,4,6-triamine
CID 53811375
methyl N-[4-(dimethylamino)-6-(methoxycarbonylamino)-1,3,5-triazin-2-yl]carbamate
CID 59582238
methyl N-[4,6-bis(methoxycarbonylamino)-1,3,5-triazin-2-yl]-N-methylcarbamate
CID 59582246

Frequently Asked Questions

What is the IUPAC name of methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate?
The IUPAC name of methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate (CID 12803256) is methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate.
What is the SMILES notation for methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate?
The canonical SMILES for methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate is COC(=O)Nc1nc(OC)nc(OC)n1.
What is the InChIKey of methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate?
The InChIKey is RLVKLOFHIMTEHE-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H10N4O4/c1-13-5-8-4(10-7(12)15-3)9-6(11-5)14-2/h1-3H3,(H,8,9,10,11,12).
What are the key properties of methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate?
methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate has a molecular weight of 214.18 g/mol, XLogP of 0.07, 3 rotatable bonds, 1 hydrogen bond donors, and 7 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(4,6-dimethoxy-1,3,5-triazin-2-yl)carbamate is sourced from PubChem (CID 12803256), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).