N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide

C22H19N5O — CID 39226018

IUPACN-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide
SMILESCc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1-n1cnnn1
InChIInChI=1S/C22H19N5O/c1-16-12-13-19(14-20(16)27-15-23-25-26-27)24-22(28)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,21H,1H3,(H,24,28)
InChIKeyZDHOGFUMQXQJDO-UHFFFAOYSA-N
MW369.43 g/mol
LogP3.74
Rot. Bonds5

About N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide

N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide (PubChem CID 39226018) has the molecular formula C22H19N5O and a molecular weight of 369.43 g/mol. Its IUPAC name is N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide.

Molecular Properties

Compound NameN-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide
PubChem CID39226018
Molecular FormulaC22H19N5O
Molecular Weight369.43 g/mol
Exact Mass369.16
IUPAC NameN-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide
SMILESCc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1-n1cnnn1
InChIInChI=1S/C22H19N5O/c1-16-12-13-19(14-20(16)27-15-23-25-26-27)24-22(28)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,21H,1H3,(H,24,28)
InChIKeyZDHOGFUMQXQJDO-UHFFFAOYSA-N
XLogP3.74
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500369.43
LogP ≤ 53.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

2,2-diphenyl-N-[3-(tetrazol-1-yl)phenyl]acetamide
CID 7694180
3-chloro-2-methyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]propanamide
CID 62728665
1,1-dimethyl-3-[4-methyl-3-(tetrazol-1-yl)phenyl]urea
CID 47033827
4-tert-butyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]benzamide
CID 855944
2-[4-methyl-3-(tetrazol-1-yl)anilino]butanoic acid
CID 115352922
2-[2-[4-methyl-3-(tetrazol-1-yl)anilino]-2-oxoethyl]sulfanylacetic acid
CID 104569427
(2S)-2-amino-4-methylsulfanyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]butanamide
CID 61154272
ethyl 2-[4-methyl-3-(tetrazol-1-yl)anilino]-2-oxoacetate
CID 50776937
N-[4-methyl-3-(tetrazol-1-yl)phenyl]-1H-pyrazole-4-carboxamide
CID 61260669
3-chloro-2,2-dimethyl-N-[4-methyl-3-(tetrazol-1-yl)phenyl]propanamide
CID 63678479
N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2-(thiophen-2-ylsulfonylamino)propanamide
CID 55911543
4-tert-butyl-N-[3-methyl-1-[4-methyl-3-(tetrazol-1-yl)anilino]-1-oxobutan-2-yl]benzamide
CID 55614160

Frequently Asked Questions

What is the IUPAC name of N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide?
The IUPAC name of N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide (CID 39226018) is N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide.
What is the SMILES notation for N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide?
The canonical SMILES for N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide is Cc1ccc(NC(=O)C(c2ccccc2)c2ccccc2)cc1-n1cnnn1.
What is the InChIKey of N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide?
The InChIKey is ZDHOGFUMQXQJDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H19N5O/c1-16-12-13-19(14-20(16)27-15-23-25-26-27)24-22(28)21(17-8-4-2-5-9-17)18-10-6-3-7-11-18/h2-15,21H,1H3,(H,24,28).
What are the key properties of N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide?
N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide has a molecular weight of 369.43 g/mol, XLogP of 3.74, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-methyl-3-(tetrazol-1-yl)phenyl]-2,2-diphenylacetamide is sourced from PubChem (CID 39226018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).