2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide

C13H15Cl2N5O2 — CID 2953553

IUPAC2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide
SMILESCCCn1nnc(NC(=O)C(C)Oc2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C13H15Cl2N5O2/c1-3-6-20-18-13(17-19-20)16-12(21)8(2)22-11-5-4-9(14)7-10(11)15/h4-5,7-8H,3,6H2,1-2H3,(H,16,18,21)
InChIKeyRGAVJMMHZAYELJ-UHFFFAOYSA-N
MW344.20 g/mol
LogP2.80
Rot. Bonds6

About 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide

2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide (PubChem CID 2953553) has the molecular formula C13H15Cl2N5O2 and a molecular weight of 344.20 g/mol. Its IUPAC name is 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide.

Molecular Properties

Compound Name2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide
PubChem CID2953553
Molecular FormulaC13H15Cl2N5O2
Molecular Weight344.20 g/mol
Exact Mass343.06
IUPAC Name2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide
SMILESCCCn1nnc(NC(=O)C(C)Oc2ccc(Cl)cc2Cl)n1
InChIInChI=1S/C13H15Cl2N5O2/c1-3-6-20-18-13(17-19-20)16-12(21)8(2)22-11-5-4-9(14)7-10(11)15/h4-5,7-8H,3,6H2,1-2H3,(H,16,18,21)
InChIKeyRGAVJMMHZAYELJ-UHFFFAOYSA-N
XLogP2.80
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500344.20
LogP ≤ 52.80
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide 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

Acetamide, 2-(2,4-dichlorophenoxy)-N-(s-triazol-3-yl)-
CID 99363
2-(2-chlorophenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893394
2-(2,4-dichlorophenoxy)-N-(2-ethyl-2H-tetrazol-5-yl)propanamide
CID 656072
2-(4-chlorophenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 648464
2-(2,4-dichlorophenoxy)-N-[5-(ethoxymethyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 3158232
2-(4-chlorophenoxy)-2-methyl-N-(2H-tetrazol-5-yl)propanamide
CID 71624133
2-(2,4-dichlorophenoxy)-N-[5-(ethylsulfanyl)-1,3,4-thiadiazol-2-yl]acetamide
CID 1021499
2-(2,4-dichlorophenoxy)-N-(4H-1,2,4-triazol-4-yl)propanamide
CID 3506212
2-(4-chloro-2-methylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893324
2-(2,4-dichlorophenoxy)-N-(1,3,4-thiadiazol-2-yl)acetamide
CID 897165
2-(2,4-dichlorophenoxy)-N-(5-methyl-1,3,4-thiadiazol-2-yl)propanamide
CID 2886229
2-(2,4-dichlorophenoxy)-N-[5-(2-methylpropyl)-1,3,4-oxadiazol-2-yl]acetamide
CID 46943241

Frequently Asked Questions

What is the IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide?
The IUPAC name of 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide (CID 2953553) is 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide.
What is the SMILES notation for 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide?
The canonical SMILES for 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide is CCCn1nnc(NC(=O)C(C)Oc2ccc(Cl)cc2Cl)n1.
What is the InChIKey of 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide?
The InChIKey is RGAVJMMHZAYELJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15Cl2N5O2/c1-3-6-20-18-13(17-19-20)16-12(21)8(2)22-11-5-4-9(14)7-10(11)15/h4-5,7-8H,3,6H2,1-2H3,(H,16,18,21).
What are the key properties of 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide?
2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide has a molecular weight of 344.20 g/mol, XLogP of 2.80, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2,4-dichlorophenoxy)-N-(2-propyltetrazol-5-yl)propanamide is sourced from PubChem (CID 2953553), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).