methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate

C10H11N5O2 — CID 145059032

IUPACmethyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate
SMILESCOC(=O)N(c1ccccc1)c1nnnn1C
InChIInChI=1S/C10H11N5O2/c1-14-9(11-12-13-14)15(10(16)17-2)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyFCFRTWMLDYBNAP-UHFFFAOYSA-N
MW233.23 g/mol
LogP1.11
Rot. Bonds2

About methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate

methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate (PubChem CID 145059032) has the molecular formula C10H11N5O2 and a molecular weight of 233.23 g/mol. Its IUPAC name is methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate.

Molecular Properties

Compound Namemethyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate
PubChem CID145059032
Molecular FormulaC10H11N5O2
Molecular Weight233.23 g/mol
Exact Mass233.09
IUPAC Namemethyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate
SMILESCOC(=O)N(c1ccccc1)c1nnnn1C
InChIInChI=1S/C10H11N5O2/c1-14-9(11-12-13-14)15(10(16)17-2)8-6-4-3-5-7-8/h3-7H,1-2H3
InChIKeyFCFRTWMLDYBNAP-UHFFFAOYSA-N
XLogP1.11
TPSA73.14 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500233.23
LogP ≤ 51.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Related Compounds

N-benzoyl-N-(1-methyltetrazol-5-yl)benzamide
CID 135343671
tert-butyl N-[4-[[[(1-methyltetrazol-5-yl)-phenylcarbamoyl]amino]methyl]-1,3-thiazol-2-yl]carbamate
CID 121272894
N'-hydroxy-3-(N-(1-methyltetrazol-5-yl)anilino)propanimidamide
CID 55166554
methyl N-(3-fluoro-4-pyrazol-1-ylphenyl)-N-phenylcarbamate
CID 174337547
methyl N-dimethoxyphosphoryl-N-phenylcarbamate
CID 23268086
(2R)-N-methyl-2-(1-methyltetrazol-5-yl)sulfanyl-N-phenylpropanamide
CID 7365414
(2R)-N-ethyl-2-(1-methyltetrazol-5-yl)sulfanyl-N-phenylpropanamide
CID 2673778
2-[methyl-(1-methyltetrazol-5-yl)amino]propanoic acid
CID 63152079
methyl N-(2-hydroxy-1H-indol-4-yl)-N-phenylcarbamate
CID 174421587
2-[(2-aminophenyl)methyl-(1-methyltetrazol-5-yl)amino]acetamide
CID 63149898
N,N',N'-triphenyloxamide
CID 54357836
2-methyl-N,N-diphenylpyrazole-3-carboxamide
CID 167438235

Frequently Asked Questions

What is the IUPAC name of methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate?
The IUPAC name of methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate (CID 145059032) is methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate.
What is the SMILES notation for methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate?
The canonical SMILES for methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate is COC(=O)N(c1ccccc1)c1nnnn1C.
What is the InChIKey of methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate?
The InChIKey is FCFRTWMLDYBNAP-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O2/c1-14-9(11-12-13-14)15(10(16)17-2)8-6-4-3-5-7-8/h3-7H,1-2H3.
What are the key properties of methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate?
methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate has a molecular weight of 233.23 g/mol, XLogP of 1.11, 2 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for methyl N-(1-methyltetrazol-5-yl)-N-phenylcarbamate is sourced from PubChem (CID 145059032), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).