N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide

C15H12ClN5O2 — CID 1080270

IUPACN-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
SMILESO=C(COc1ccc(-n2cnnn2)cc1)Nc1ccccc1Cl
InChIInChI=1S/C15H12ClN5O2/c16-13-3-1-2-4-14(13)18-15(22)9-23-12-7-5-11(6-8-12)21-10-17-19-20-21/h1-8,10H,9H2,(H,18,22)
InChIKeyLVWBSDZAFFHQMF-UHFFFAOYSA-N
MW329.75 g/mol
LogP2.33
Rot. Bonds5

About N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide

N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide (PubChem CID 1080270) has the molecular formula C15H12ClN5O2 and a molecular weight of 329.75 g/mol. Its IUPAC name is N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide.

Molecular Properties

Compound NameN-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
PubChem CID1080270
Molecular FormulaC15H12ClN5O2
Molecular Weight329.75 g/mol
Exact Mass329.07
IUPAC NameN-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
SMILESO=C(COc1ccc(-n2cnnn2)cc1)Nc1ccccc1Cl
InChIInChI=1S/C15H12ClN5O2/c16-13-3-1-2-4-14(13)18-15(22)9-23-12-7-5-11(6-8-12)21-10-17-19-20-21/h1-8,10H,9H2,(H,18,22)
InChIKeyLVWBSDZAFFHQMF-UHFFFAOYSA-N
XLogP2.33
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500329.75
LogP ≤ 52.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-methoxyphenyl)-2-[3-(1H-tetraazol-1-yl)phenoxy]acetamide
CID 1140121
N-(3-chloro-4-fluorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 2519672
N-(2-Methoxy-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 647163
N-(2,3-Dichloro-phenyl)-2-(4-tetrazol-1-yl-phenoxy)-acetamide
CID 1135809
N-(4-Methoxy-phenyl)-2-(3-tetrazol-1-yl-phenoxy)-acetamide
CID 1140123
2-[4-(Tetrazol-1-yl)phenoxy]acetamide
CID 817506
N-(4-chloro-2,5-dimethoxyphenyl)-2-[4-(1-tetrazolyl)phenoxy]acetamide
CID 1139897
N-[2-(4-fluorophenyl)ethyl]-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 2090859
N-(3-chloro-4-methoxyphenyl)-2-[3-(tetrazol-1-yl)phenoxy]acetamide
CID 2709072
N-(2-butan-2-ylphenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide
CID 4793663
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-(4-fluorophenoxy)acetamide
CID 18170239
N-[5-chloro-2-(1,2,4-triazol-1-yl)phenyl]-2-phenoxybutanamide
CID 24982705

Frequently Asked Questions

What is the IUPAC name of N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The IUPAC name of N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide (CID 1080270) is N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide.
What is the SMILES notation for N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The canonical SMILES for N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide is O=C(COc1ccc(-n2cnnn2)cc1)Nc1ccccc1Cl.
What is the InChIKey of N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
The InChIKey is LVWBSDZAFFHQMF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H12ClN5O2/c16-13-3-1-2-4-14(13)18-15(22)9-23-12-7-5-11(6-8-12)21-10-17-19-20-21/h1-8,10H,9H2,(H,18,22).
What are the key properties of N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide?
N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide has a molecular weight of 329.75 g/mol, XLogP of 2.33, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-chlorophenyl)-2-[4-(tetrazol-1-yl)phenoxy]acetamide is sourced from PubChem (CID 1080270), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).