2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide

C11H12N6O2 — CID 858278

IUPAC2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide
SMILESCC(=O)Nc1ccccc1-c1nnn(CC(N)=O)n1
InChIInChI=1S/C11H12N6O2/c1-7(18)13-9-5-3-2-4-8(9)11-14-16-17(15-11)6-10(12)19/h2-5H,6H2,1H3,(H2,12,19)(H,13,18)
InChIKeyGYMQUKRWCRLDNS-UHFFFAOYSA-N
MW260.26 g/mol
LogP-0.22
Rot. Bonds4

About 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide

2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide (PubChem CID 858278) has the molecular formula C11H12N6O2 and a molecular weight of 260.26 g/mol. Its IUPAC name is 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide.

Molecular Properties

Compound Name2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide
PubChem CID858278
Molecular FormulaC11H12N6O2
Molecular Weight260.26 g/mol
Exact Mass260.10
IUPAC Name2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide
SMILESCC(=O)Nc1ccccc1-c1nnn(CC(N)=O)n1
InChIInChI=1S/C11H12N6O2/c1-7(18)13-9-5-3-2-4-8(9)11-14-16-17(15-11)6-10(12)19/h2-5H,6H2,1H3,(H2,12,19)(H,13,18)
InChIKeyGYMQUKRWCRLDNS-UHFFFAOYSA-N
XLogP-0.22
TPSA115.79 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.26
LogP ≤ 5-0.22
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-(2H-Tetrazol-5-yl)phenyl)acetamide
CID 3055901
N-[4-(2H-tetrazol-5-yl)phenyl]acetamide
CID 890652
N-[2-(2H-Tetrazol-5-yl)phenyl]acetamide
CID 4440906
N-(2,6-Diisopropyl-phenyl)-2-(2-dodecyl-2H-tetrazol-5-yl)-acetamide
CID 9868635
N-(2,6-Diisopropyl-phenyl)-2-(5-dodecyl-tetrazol-2-yl)-acetamide
CID 10599875
Cyclopropanecarboxylic acid [2-(2-cyclohexylcarbamoylmethyl-2H-tetrazol-5-yl)-phenyl]-amide
CID 647142
N-(2-{2-[2-(2-Methyl-2,3-dihydro-indol-1-yl)-2-oxo-ethyl]-2H-tetrazol-5-yl}-phenyl)-propionamide
CID 650750
N-[2-(2-Ethyl-2H-tetrazol-5-yl)-phenyl]-2,2,2-trifluoro-acetamide
CID 652435
N-[2-[2-[2-(3,4-dihydro-1H-isoquinolin-2-yl)-2-oxoethyl]tetrazol-5-yl]phenyl]-3-methylbutanamide
CID 1440203
N-(2,6-dimethylphenyl)-2-[5-[4-[(4-methylpiperidin-1-yl)methyl]phenyl]tetrazol-2-yl]acetamide
CID 1462999
N-[2-(2-phenyltetrazol-5-yl)phenyl]cyclohexanecarboxamide
CID 145974134
2-[5-(4-Amino-phenyl)-tetrazol-2-yl]-1-piperidin-1-yl-ethanone
CID 1132849

Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide?
The IUPAC name of 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide (CID 858278) is 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide.
What is the SMILES notation for 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide?
The canonical SMILES for 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide is CC(=O)Nc1ccccc1-c1nnn(CC(N)=O)n1.
What is the InChIKey of 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide?
The InChIKey is GYMQUKRWCRLDNS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12N6O2/c1-7(18)13-9-5-3-2-4-8(9)11-14-16-17(15-11)6-10(12)19/h2-5H,6H2,1H3,(H2,12,19)(H,13,18).
What are the key properties of 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide?
2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide has a molecular weight of 260.26 g/mol, XLogP of -0.22, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-acetamidophenyl)tetrazol-2-yl]acetamide is sourced from PubChem (CID 858278), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).