2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide

C15H10ClF2N5O — CID 586782

IUPAC2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccc(F)cc1F
InChIInChI=1S/C15H10ClF2N5O/c16-11-4-2-1-3-10(11)15-20-22-23(21-15)8-14(24)19-13-6-5-9(17)7-12(13)18/h1-7H,8H2,(H,19,24)
InChIKeyUGAZHMOEFIALIK-UHFFFAOYSA-N
MW349.73 g/mol
LogP2.91
Rot. Bonds4

About 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide

2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide (PubChem CID 586782) has the molecular formula C15H10ClF2N5O and a molecular weight of 349.73 g/mol. Its IUPAC name is 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide.

Molecular Properties

Compound Name2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide
PubChem CID586782
Molecular FormulaC15H10ClF2N5O
Molecular Weight349.73 g/mol
Exact Mass349.05
IUPAC Name2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide
SMILESO=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccc(F)cc1F
InChIInChI=1S/C15H10ClF2N5O/c16-11-4-2-1-3-10(11)15-20-22-23(21-15)8-14(24)19-13-6-5-9(17)7-12(13)18/h1-7H,8H2,(H,19,24)
InChIKeyUGAZHMOEFIALIK-UHFFFAOYSA-N
XLogP2.91
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.73
LogP ≤ 52.91
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide?
The IUPAC name of 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide (CID 586782) is 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide.
What is the SMILES notation for 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide?
The canonical SMILES for 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide is O=C(Cn1nnc(-c2ccccc2Cl)n1)Nc1ccc(F)cc1F.
What is the InChIKey of 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide?
The InChIKey is UGAZHMOEFIALIK-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H10ClF2N5O/c16-11-4-2-1-3-10(11)15-20-22-23(21-15)8-14(24)19-13-6-5-9(17)7-12(13)18/h1-7H,8H2,(H,19,24).
What are the key properties of 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide?
2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide has a molecular weight of 349.73 g/mol, XLogP of 2.91, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-(2,4-difluorophenyl)acetamide is sourced from PubChem (CID 586782), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).