N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide

C17H17N5OS — CID 555650

IUPACN-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
SMILESCCc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)cc1
InChIInChI=1S/C17H17N5OS/c1-2-13-8-10-14(11-9-13)18-16(23)12-24-17-19-20-21-22(17)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3,(H,18,23)
InChIKeyVNIXNXIQVMEKML-UHFFFAOYSA-N
MW339.42 g/mol
LogP2.96
Rot. Bonds6

About N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide

N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide (PubChem CID 555650) has the molecular formula C17H17N5OS and a molecular weight of 339.42 g/mol. Its IUPAC name is N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide.

Molecular Properties

Compound NameN-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
PubChem CID555650
Molecular FormulaC17H17N5OS
Molecular Weight339.42 g/mol
Exact Mass339.12
IUPAC NameN-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
SMILESCCc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)cc1
InChIInChI=1S/C17H17N5OS/c1-2-13-8-10-14(11-9-13)18-16(23)12-24-17-19-20-21-22(17)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3,(H,18,23)
InChIKeyVNIXNXIQVMEKML-UHFFFAOYSA-N
XLogP2.96
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500339.42
LogP ≤ 52.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

N-(4-ethylphenyl)-2-[1-(4-fluorophenyl)tetrazol-5-yl]sulfanylacetamide
CID 18874225
N-(4-tert-butylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
CID 982894
N,N-diethyl-4-[[2-(1-phenyltetrazol-5-yl)sulfanylacetyl]amino]benzamide
CID 7762487
N-(2-ethylphenyl)-2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 1405208
2-[[2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylacetyl]amino]benzoic acid
CID 18874200
N-[(1S)-1-(4-ethylphenyl)ethyl]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
CID 7757116
N-(4-ethylphenyl)-2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 3671100
N-(2,6-dimethylphenyl)-2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 1449734
methyl 4-[5-(2-anilino-2-oxoethyl)sulfanyltetrazol-1-yl]benzoate
CID 1323060
N-[4-(4-acetylpiperazin-1-yl)phenyl]-2-(1-phenyltetrazol-5-yl)sulfanylacetamide
CID 3912516
2-[1-(3-methylphenyl)tetrazol-5-yl]sulfanyl-N-phenylacetamide
CID 853335
N-(2,3-dihydro-1,4-benzodioxin-6-yl)-2-[1-(4-ethylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 1449756

Frequently Asked Questions

What is the IUPAC name of N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide?
The IUPAC name of N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide (CID 555650) is N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide.
What is the SMILES notation for N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide?
The canonical SMILES for N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide is CCc1ccc(NC(=O)CSc2nnnn2-c2ccccc2)cc1.
What is the InChIKey of N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide?
The InChIKey is VNIXNXIQVMEKML-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17N5OS/c1-2-13-8-10-14(11-9-13)18-16(23)12-24-17-19-20-21-22(17)15-6-4-3-5-7-15/h3-11H,2,12H2,1H3,(H,18,23).
What are the key properties of N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide?
N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide has a molecular weight of 339.42 g/mol, XLogP of 2.96, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-ethylphenyl)-2-(1-phenyltetrazol-5-yl)sulfanylacetamide is sourced from PubChem (CID 555650), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).