N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide

C15H11Cl2N5O — CID 2295012

IUPACN-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
SMILESO=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccccc1Cl
InChIInChI=1S/C15H11Cl2N5O/c16-11-6-2-1-5-10(11)15-19-21-22(20-15)9-14(23)18-13-8-4-3-7-12(13)17/h1-8H,9H2,(H,18,23)
InChIKeyDUNWNBNAXMQGBX-UHFFFAOYSA-N
MW348.19 g/mol
LogP3.29
Rot. Bonds4

About N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide

N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide (PubChem CID 2295012) has the molecular formula C15H11Cl2N5O and a molecular weight of 348.19 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
PubChem CID2295012
Molecular FormulaC15H11Cl2N5O
Molecular Weight348.19 g/mol
Exact Mass347.03
IUPAC NameN-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
SMILESO=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccccc1Cl
InChIInChI=1S/C15H11Cl2N5O/c16-11-6-2-1-5-10(11)15-19-21-22(20-15)9-14(23)18-13-8-4-3-7-12(13)17/h1-8H,9H2,(H,18,23)
InChIKeyDUNWNBNAXMQGBX-UHFFFAOYSA-N
XLogP3.29
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.19
LogP ≤ 53.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide (CID 2295012) is N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide is O=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The InChIKey is DUNWNBNAXMQGBX-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11Cl2N5O/c16-11-6-2-1-5-10(11)15-19-21-22(20-15)9-14(23)18-13-8-4-3-7-12(13)17/h1-8H,9H2,(H,18,23).
What are the key properties of N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide has a molecular weight of 348.19 g/mol, XLogP of 3.29, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide is sourced from PubChem (CID 2295012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).