2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide

C10H11N5O — CID 3054058

IUPAC2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide
SMILESCc1ccccc1-n1nnnc1CC(N)=O
InChIInChI=1S/C10H11N5O/c1-7-4-2-3-5-8(7)15-10(6-9(11)16)12-13-14-15/h2-5H,6H2,1H3,(H2,11,16)
InChIKeyKKWKSBUMTGMCHS-UHFFFAOYSA-N
MW217.23 g/mol
LogP-0.00
Rot. Bonds3

About 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide

2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide (PubChem CID 3054058) has the molecular formula C10H11N5O and a molecular weight of 217.23 g/mol. Its IUPAC name is 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide.

Molecular Properties

Compound Name2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide
PubChem CID3054058
Molecular FormulaC10H11N5O
Molecular Weight217.23 g/mol
Exact Mass217.10
IUPAC Name2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide
SMILESCc1ccccc1-n1nnnc1CC(N)=O
InChIInChI=1S/C10H11N5O/c1-7-4-2-3-5-8(7)15-10(6-9(11)16)12-13-14-15/h2-5H,6H2,1H3,(H2,11,16)
InChIKeyKKWKSBUMTGMCHS-UHFFFAOYSA-N
XLogP-0.00
TPSA86.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.23
LogP ≤ 5-0.00
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

1-(2-Methylphenyl)-5-phenyl-1H-tetrazole
CID 2054464
N-{[2-(3,5-Dimethyl-4h-1,2,4-Triazol-4-Yl)phenyl]methyl}acetamide
CID 131633051
N-[2-Methyl-5-(1H-tetrazol-1-yl)phenyl]acetamide
CID 855910
2-[1-(2-Methylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 2388289
3-[1-(2,6-dimethylphenyl)tetrazol-5-yl]-1H-quinoxalin-2-one
CID 136153824
Tetrazole,5-amino-1-(O-tolyl)
CID 285156
1H-Tetrazole-5-acetamide, N-(4-methylphenyl)-
CID 3054057
1H-Tetrazole-5-acetamide, N-1-naphthalenyl-
CID 3054061
N-(2-methylphenyl)-2-[3-(5-methyltetrazol-1-yl)anilino]acetamide
CID 36912531
4-[3-isobutyl-1-(3-methylphenyl)-1H-1,2,4-triazol-5-yl]butanamide
CID 50969925
5-methyl-1-(3-methylphenyl)-1H-tetrazole
CID 5151534
3-methyl-4-[5-(propan-2-yl)-1H-1,2,3,4-tetrazol-1-yl]aniline hydrochloride
CID 75418609

Frequently Asked Questions

What is the IUPAC name of 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide?
The IUPAC name of 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide (CID 3054058) is 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide.
What is the SMILES notation for 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide?
The canonical SMILES for 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide is Cc1ccccc1-n1nnnc1CC(N)=O.
What is the InChIKey of 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide?
The InChIKey is KKWKSBUMTGMCHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N5O/c1-7-4-2-3-5-8(7)15-10(6-9(11)16)12-13-14-15/h2-5H,6H2,1H3,(H2,11,16).
What are the key properties of 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide?
2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide has a molecular weight of 217.23 g/mol, XLogP of -0.00, 3 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[1-(2-methylphenyl)tetrazol-5-yl]acetamide is sourced from PubChem (CID 3054058), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).