2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide

C15H11ClFN5O — CID 2534187

IUPAC2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1c(F)cccc1Cl)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H11ClFN5O/c16-13-2-1-3-14(17)12(13)8-15(23)19-10-4-6-11(7-5-10)22-9-18-20-21-22/h1-7,9H,8H2,(H,19,23)
InChIKeyLQHXNZKFHAZKLH-UHFFFAOYSA-N
MW331.74 g/mol
LogP2.64
Rot. Bonds4

About 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide

2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide (PubChem CID 2534187) has the molecular formula C15H11ClFN5O and a molecular weight of 331.74 g/mol. Its IUPAC name is 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide.

Molecular Properties

Compound Name2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
PubChem CID2534187
Molecular FormulaC15H11ClFN5O
Molecular Weight331.74 g/mol
Exact Mass331.06
IUPAC Name2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
SMILESO=C(Cc1c(F)cccc1Cl)Nc1ccc(-n2cnnn2)cc1
InChIInChI=1S/C15H11ClFN5O/c16-13-2-1-3-14(17)12(13)8-15(23)19-10-4-6-11(7-5-10)22-9-18-20-21-22/h1-7,9H,8H2,(H,19,23)
InChIKeyLQHXNZKFHAZKLH-UHFFFAOYSA-N
XLogP2.64
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500331.74
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2-(2-chlorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide
CID 8006243
2-(2,6-dichlorophenyl)-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 7692890
2-(2-chloro-6-fluorophenyl)-N-(4-chlorophenyl)acetamide
CID 9413330
2-(2-chloro-6-fluorophenyl)-N-(4-hydroxyphenyl)acetamide
CID 28831544
2-(2-chloro-6-fluorophenyl)-N-[4-(trifluoromethyl)phenyl]acetamide
CID 7962141
2-(2-chloro-6-fluorophenyl)-N-(4-methylphenyl)acetamide
CID 2112014
2-(2-chloro-6-fluorophenyl)-N-([1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl)acetamide
CID 2471351
3-chloro-N-[4-(tetrazol-1-yl)phenyl]propanamide
CID 43167870
2-(2-chloro-6-fluorophenyl)-N-(3-chloro-4-fluorophenyl)acetamide
CID 9165979
2,3-dichloro-N-[4-(tetrazol-1-yl)phenyl]benzamide
CID 26729277
3-(2-chloro-6-fluorophenyl)-5-methyl-N-[4-(tetrazol-1-yl)phenyl]-1,2-oxazole-4-carboxamide
CID 9450875
2-(2-chloro-6-fluorophenyl)-N-[4-[(2-methoxyacetyl)amino]phenyl]acetamide
CID 35332134

Frequently Asked Questions

What is the IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The IUPAC name of 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide (CID 2534187) is 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide.
What is the SMILES notation for 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The canonical SMILES for 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide is O=C(Cc1c(F)cccc1Cl)Nc1ccc(-n2cnnn2)cc1.
What is the InChIKey of 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
The InChIKey is LQHXNZKFHAZKLH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H11ClFN5O/c16-13-2-1-3-14(17)12(13)8-15(23)19-10-4-6-11(7-5-10)22-9-18-20-21-22/h1-7,9H,8H2,(H,19,23).
What are the key properties of 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide?
2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide has a molecular weight of 331.74 g/mol, XLogP of 2.64, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-chloro-6-fluorophenyl)-N-[4-(tetrazol-1-yl)phenyl]acetamide is sourced from PubChem (CID 2534187), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).