tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate

C14H24N2O3 — CID 144743274

IUPACtert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate
SMILESCc1c(N(C)C(=O)OC(C)(C)C)noc1C(C)(C)C
InChIInChI=1S/C14H24N2O3/c1-9-10(13(2,3)4)19-15-11(9)16(8)12(17)18-14(5,6)7/h1-8H3
InChIKeyYMXJZVHGSZDSMB-UHFFFAOYSA-N
MW268.36 g/mol
LogP3.65
Rot. Bonds1

About tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate

tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate (PubChem CID 144743274) has the molecular formula C14H24N2O3 and a molecular weight of 268.36 g/mol. Its IUPAC name is tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate.

Molecular Properties

Compound Nametert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate
PubChem CID144743274
Molecular FormulaC14H24N2O3
Molecular Weight268.36 g/mol
Exact Mass268.18
IUPAC Nametert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate
SMILESCc1c(N(C)C(=O)OC(C)(C)C)noc1C(C)(C)C
InChIInChI=1S/C14H24N2O3/c1-9-10(13(2,3)4)19-15-11(9)16(8)12(17)18-14(5,6)7/h1-8H3
InChIKeyYMXJZVHGSZDSMB-UHFFFAOYSA-N
XLogP3.65
TPSA55.57 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.36
LogP ≤ 53.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

tert-butyl N-(6-amino-1,2-benzoxazol-3-yl)-N-methylcarbamate
CID 155113166
tert-butyl N-[6-(methoxyamino)-1,2-benzoxazol-3-yl]-N-methylcarbamate
CID 155113636
tert-butyl N-imidazo[1,2-a]pyrazin-8-yl-N-methylcarbamate
CID 141203596
ethyl 5-tert-butyl-3-[2-[(2-methylpropan-2-yl)oxy]-2-oxoethyl]-1,2-oxazole-4-carboxylate
CID 149081688
5-tert-butyl-4-methyl-1,2-oxazole-3-carboxylate
CID 56924170
tert-butyl N-(5-acetylpyrimidin-2-yl)-N-methylcarbamate
CID 140897159
tert-butyl N-methyl-N-(2,3,4,5,6-pentafluorophenyl)carbamate
CID 172558948
tert-butyl N-[3-(bromomethyl)-2-pyridinyl]-N-methylcarbamate
CID 141274850
tert-butyl N-(6-amino-3-methoxy-2-pyridinyl)-N-methylcarbamate
CID 90054827
tert-butyl N-(4-chloro-3-fluoro-2-pyridinyl)-N-methylcarbamate
CID 152843772
tert-butyl N-(5-bromo-4-cyano-1H-pyrazol-3-yl)-N-methylcarbamate
CID 168927877
tert-butyl N-(4-fluoro-2-methylphenyl)-N-methylcarbamate
CID 150785471

Frequently Asked Questions

What is the IUPAC name of tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate?
The IUPAC name of tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate (CID 144743274) is tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate.
What is the SMILES notation for tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate?
The canonical SMILES for tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate is Cc1c(N(C)C(=O)OC(C)(C)C)noc1C(C)(C)C.
What is the InChIKey of tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate?
The InChIKey is YMXJZVHGSZDSMB-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O3/c1-9-10(13(2,3)4)19-15-11(9)16(8)12(17)18-14(5,6)7/h1-8H3.
What are the key properties of tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate?
tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate has a molecular weight of 268.36 g/mol, XLogP of 3.65, 1 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for tert-butyl N-(5-tert-butyl-4-methyl-1,2-oxazol-3-yl)-N-methylcarbamate is sourced from PubChem (CID 144743274), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).