N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide

C16H10Cl2N6O — CID 7634919

IUPACN-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
SMILESN#Cc1ccc(NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc1Cl
InChIInChI=1S/C16H10Cl2N6O/c17-13-4-2-1-3-12(13)16-21-23-24(22-16)9-15(25)20-11-6-5-10(8-19)14(18)7-11/h1-7H,9H2,(H,20,25)
InChIKeyYDXHVLXHTLDFRC-UHFFFAOYSA-N
MW373.20 g/mol
LogP3.16
Rot. Bonds4

About N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide

N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide (PubChem CID 7634919) has the molecular formula C16H10Cl2N6O and a molecular weight of 373.20 g/mol. Its IUPAC name is N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide.

Molecular Properties

Compound NameN-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
PubChem CID7634919
Molecular FormulaC16H10Cl2N6O
Molecular Weight373.20 g/mol
Exact Mass372.03
IUPAC NameN-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
SMILESN#Cc1ccc(NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc1Cl
InChIInChI=1S/C16H10Cl2N6O/c17-13-4-2-1-3-12(13)16-21-23-24(22-16)9-15(25)20-11-6-5-10(8-19)14(18)7-11/h1-7H,9H2,(H,20,25)
InChIKeyYDXHVLXHTLDFRC-UHFFFAOYSA-N
XLogP3.16
TPSA96.49 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500373.20
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(3-chloro-4-methoxyphenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide
CID 7634847
N-(4-chloro-3-morpholin-4-ylsulfonylphenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
CID 5095332
2-[5-(2-chlorophenyl)tetrazol-2-yl]acetate
CID 6922149
N-(4-chloro-3-methylphenyl)-2-(5-phenyltetrazol-2-yl)acetamide
CID 17014887
2-[5-(2-cyanophenyl)tetrazol-2-yl]acetohydrazide
CID 4139717
2-[5-(2-chlorophenyl)tetrazol-2-yl]-N-[(1S)-1-cyano-1-cyclopropylethyl]acetamide
CID 7350365
N-[2-chloro-5-(dimethylsulfamoyl)phenyl]-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
CID 4304927
2-[5-(2-methylphenyl)tetrazol-2-yl]-N-(4-propan-2-ylphenyl)acetamide
CID 3265449
N-[(2S)-butan-2-yl]-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide
CID 7634924
N-[4-(cyanomethyl)phenyl]-2-(5-phenyltetrazol-2-yl)acetamide
CID 3995748
N-(4-bromophenyl)-2-[5-(2-methylphenyl)tetrazol-2-yl]acetamide
CID 3424569
2-(3-aminopyrazol-1-yl)-N-(3-chloro-4-cyanophenyl)acetamide
CID 55036060

Frequently Asked Questions

What is the IUPAC name of N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The IUPAC name of N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide (CID 7634919) is N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide.
What is the SMILES notation for N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The canonical SMILES for N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide is N#Cc1ccc(NC(=O)Cn2nnc(-c3ccccc3Cl)n2)cc1Cl.
What is the InChIKey of N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
The InChIKey is YDXHVLXHTLDFRC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H10Cl2N6O/c17-13-4-2-1-3-12(13)16-21-23-24(22-16)9-15(25)20-11-6-5-10(8-19)14(18)7-11/h1-7H,9H2,(H,20,25).
What are the key properties of N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide?
N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide has a molecular weight of 373.20 g/mol, XLogP of 3.16, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3-chloro-4-cyanophenyl)-2-[5-(2-chlorophenyl)tetrazol-2-yl]acetamide is sourced from PubChem (CID 7634919), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).