2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide

C10H8N6O2 — CID 2374767

IUPAC2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide
SMILESN#Cc1ccc(OCC(=O)Nc2nn[nH]n2)cc1
InChIInChI=1S/C10H8N6O2/c11-5-7-1-3-8(4-2-7)18-6-9(17)12-10-13-15-16-14-10/h1-4H,6H2,(H2,12,13,14,15,16,17)
InChIKeyVCYANYQSCHHBTR-UHFFFAOYSA-N
MW244.21 g/mol
LogP0.09
Rot. Bonds4

About 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide

2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide (PubChem CID 2374767) has the molecular formula C10H8N6O2 and a molecular weight of 244.21 g/mol. Its IUPAC name is 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide
PubChem CID2374767
Molecular FormulaC10H8N6O2
Molecular Weight244.21 g/mol
Exact Mass244.07
IUPAC Name2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide
SMILESN#Cc1ccc(OCC(=O)Nc2nn[nH]n2)cc1
InChIInChI=1S/C10H8N6O2/c11-5-7-1-3-8(4-2-7)18-6-9(17)12-10-13-15-16-14-10/h1-4H,6H2,(H2,12,13,14,15,16,17)
InChIKeyVCYANYQSCHHBTR-UHFFFAOYSA-N
XLogP0.09
TPSA116.58 Ų
H-Bond Donors2
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500244.21
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 106

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Related Compounds

N-(4-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7966728
N-(4-cyanophenyl)-2-[4-(methylamino)phenoxy]acetamide
CID 61027849
N-(4-bromophenyl)-2-(4-cyanophenoxy)acetamide
CID 7818711
2-(4-cyanophenoxy)-N-pyridin-3-ylacetamide
CID 24707250
2-[4-(cyanomethyl)phenoxy]-N-(4-cyanophenyl)acetamide
CID 43824284
N-(4-methylphenyl)-2-[4-[(2H-tetrazol-5-ylamino)methyl]phenoxy]acetamide
CID 66539248
N-(4-bromophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 3473577
2-(4-cyanophenoxy)-N-(3,4-dimethylphenyl)acetamide
CID 8744068
N-(4-cyanophenyl)-2-quinoxalin-6-yloxyacetamide
CID 3903681
2-(4-cyanophenoxy)-N-(pentan-3-ylideneamino)acetamide
CID 4082940
N-(3-acetamido-2-methylphenyl)-2-(4-cyanophenoxy)acetamide
CID 134019347
N-(2-cyanophenyl)-2-[4-(4-cyanophenyl)phenoxy]acetamide
CID 7670915

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide?
The IUPAC name of 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide (CID 2374767) is 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide.
What is the SMILES notation for 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide?
The canonical SMILES for 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide is N#Cc1ccc(OCC(=O)Nc2nn[nH]n2)cc1.
What is the InChIKey of 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide?
The InChIKey is VCYANYQSCHHBTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H8N6O2/c11-5-7-1-3-8(4-2-7)18-6-9(17)12-10-13-15-16-14-10/h1-4H,6H2,(H2,12,13,14,15,16,17).
What are the key properties of 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide?
2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide has a molecular weight of 244.21 g/mol, XLogP of 0.09, 4 rotatable bonds, 2 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyanophenoxy)-N-(2H-tetrazol-5-yl)acetamide is sourced from PubChem (CID 2374767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).