2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide

C19H15N5OS — CID 2265468

IUPAC2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide
SMILESO=C(CSc1nnnn1-c1cccc2ccccc12)Nc1ccccc1
InChIInChI=1S/C19H15N5OS/c25-18(20-15-9-2-1-3-10-15)13-26-19-21-22-23-24(19)17-12-6-8-14-7-4-5-11-16(14)17/h1-12H,13H2,(H,20,25)
InChIKeyMCOBRCSJMYBCEQ-UHFFFAOYSA-N
MW361.43 g/mol
LogP3.55
Rot. Bonds5

About 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide

2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide (PubChem CID 2265468) has the molecular formula C19H15N5OS and a molecular weight of 361.43 g/mol. Its IUPAC name is 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide.

Molecular Properties

Compound Name2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide
PubChem CID2265468
Molecular FormulaC19H15N5OS
Molecular Weight361.43 g/mol
Exact Mass361.10
IUPAC Name2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide
SMILESO=C(CSc1nnnn1-c1cccc2ccccc12)Nc1ccccc1
InChIInChI=1S/C19H15N5OS/c25-18(20-15-9-2-1-3-10-15)13-26-19-21-22-23-24(19)17-12-6-8-14-7-4-5-11-16(14)17/h1-12H,13H2,(H,20,25)
InChIKeyMCOBRCSJMYBCEQ-UHFFFAOYSA-N
XLogP3.55
TPSA72.70 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500361.43
LogP ≤ 53.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide 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-(2-chlorophenyl)-2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylacetamide
CID 5275073
N-benzhydryl-2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylacetamide
CID 1244330
2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-(2-sulfamoylphenyl)acetamide
CID 5275084
2-[1-(3-methylphenyl)tetrazol-5-yl]sulfanyl-N-phenylacetamide
CID 853335
N-[(2-hydroxyphenyl)methylideneamino]-2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylacetamide
CID 137228450
4-[[2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanylacetyl]amino]benzamide
CID 16536135
N-[(E)-(4-fluorophenyl)methylideneamino]-2-(1-naphthalen-1-yltetrazol-5-yl)sulfanylacetamide
CID 71588657
N-(3,5-dimethylphenyl)-2-[1-(2-methylphenyl)tetrazol-5-yl]sulfanylacetamide
CID 5137050
3-[1-(2-methylphenyl)tetrazol-5-yl]sulfanyl-N-phenylpropanamide
CID 3503382
N-(4-fluorophenyl)-2-[1-(2-methoxyphenyl)tetrazol-5-yl]sulfanylacetamide
CID 3587799
2-[1-(2-ethylphenyl)tetrazol-5-yl]sulfanyl-N-(3-methoxyphenyl)acetamide
CID 6491205
2-[1-(2,6-dimethylphenyl)tetrazol-5-yl]sulfanyl-N-naphthalen-1-ylacetamide
CID 26650117

Frequently Asked Questions

What is the IUPAC name of 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide?
The IUPAC name of 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide (CID 2265468) is 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide.
What is the SMILES notation for 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide?
The canonical SMILES for 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide is O=C(CSc1nnnn1-c1cccc2ccccc12)Nc1ccccc1.
What is the InChIKey of 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide?
The InChIKey is MCOBRCSJMYBCEQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H15N5OS/c25-18(20-15-9-2-1-3-10-15)13-26-19-21-22-23-24(19)17-12-6-8-14-7-4-5-11-16(14)17/h1-12H,13H2,(H,20,25).
What are the key properties of 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide?
2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide has a molecular weight of 361.43 g/mol, XLogP of 3.55, 5 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1-naphthalen-1-yltetrazol-5-yl)sulfanyl-N-phenylacetamide is sourced from PubChem (CID 2265468), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).