methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate

C7H11N3O3 — CID 110320279

IUPACmethyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
SMILESCOC(=O)NCCc1nnc(C)o1
InChIInChI=1S/C7H11N3O3/c1-5-9-10-6(13-5)3-4-8-7(11)12-2/h3-4H2,1-2H3,(H,8,11)
InChIKeyZFUUJGMTAMCGBV-UHFFFAOYSA-N
MW185.18 g/mol
LogP0.28
Rot. Bonds3

About methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate

methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate (PubChem CID 110320279) has the molecular formula C7H11N3O3 and a molecular weight of 185.18 g/mol. Its IUPAC name is methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate.

Molecular Properties

Compound Namemethyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
PubChem CID110320279
Molecular FormulaC7H11N3O3
Molecular Weight185.18 g/mol
Exact Mass185.08
IUPAC Namemethyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
SMILESCOC(=O)NCCc1nnc(C)o1
InChIInChI=1S/C7H11N3O3/c1-5-9-10-6(13-5)3-4-8-7(11)12-2/h3-4H2,1-2H3,(H,8,11)
InChIKeyZFUUJGMTAMCGBV-UHFFFAOYSA-N
XLogP0.28
TPSA77.25 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.18
LogP ≤ 50.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

ethyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 110320280
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propanamide
CID 110320204
2-methoxy-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 110320225
tert-butyl N-[2-(5-tert-butyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 77231283
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]-4-phenylbenzamide
CID 110320276
methyl N-[2-[5-(3-methoxyphenyl)-1,3,4-oxadiazol-2-yl]ethyl]carbamate
CID 110321860
tert-butyl N-[2-(5-ethylsulfanyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate
CID 937933
N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propan-1-amine
CID 62162393
2-methyl-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]propan-2-amine
CID 62163830
(5-methyl-1,3,4-oxadiazol-2-yl)methylurea
CID 130738422
4-(dimethylsulfamoyl)-N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]benzamide
CID 110320250
methyl N-[2-(5-methyl-1,3,4-thiadiazol-2-yl)ethyl]carbamate
CID 110870268

Frequently Asked Questions

What is the IUPAC name of methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The IUPAC name of methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate (CID 110320279) is methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate.
What is the SMILES notation for methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The canonical SMILES for methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is COC(=O)NCCc1nnc(C)o1.
What is the InChIKey of methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
The InChIKey is ZFUUJGMTAMCGBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H11N3O3/c1-5-9-10-6(13-5)3-4-8-7(11)12-2/h3-4H2,1-2H3,(H,8,11).
What are the key properties of methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate?
methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate has a molecular weight of 185.18 g/mol, XLogP of 0.28, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-[2-(5-methyl-1,3,4-oxadiazol-2-yl)ethyl]carbamate is sourced from PubChem (CID 110320279), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).