2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide

C12H15N5O2 — CID 954295

IUPAC2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide
SMILESCCCn1nnc(NC(=O)COc2ccccc2)n1
InChIInChI=1S/C12H15N5O2/c1-2-8-17-15-12(14-16-17)13-11(18)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,15,18)
InChIKeyQXNVPPGBGKVGFJ-UHFFFAOYSA-N
MW261.28 g/mol
LogP1.10
Rot. Bonds6

About 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide

2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide (PubChem CID 954295) has the molecular formula C12H15N5O2 and a molecular weight of 261.28 g/mol. Its IUPAC name is 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide.

Molecular Properties

Compound Name2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide
PubChem CID954295
Molecular FormulaC12H15N5O2
Molecular Weight261.28 g/mol
Exact Mass261.12
IUPAC Name2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide
SMILESCCCn1nnc(NC(=O)COc2ccccc2)n1
InChIInChI=1S/C12H15N5O2/c1-2-8-17-15-12(14-16-17)13-11(18)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,15,18)
InChIKeyQXNVPPGBGKVGFJ-UHFFFAOYSA-N
XLogP1.10
TPSA81.93 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 51.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

2-Phenoxy-N-(4H-[1,2,4]triazol-3-yl)-acetamide
CID 555301
2-phenoxy-N-(5-prop-2-enylsulfanyl-1,3,4-thiadiazol-2-yl)acetamide
CID 2102404
2-(4-ethylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893388
2-(2-chlorophenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893394
2-(4-cyclohexylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 893627
2-(2-isopropyl-5-methylphenoxy)-N-(2-propyl-2H-tetrazol-5-yl)acetamide
CID 2193871
N-(5-ethylsulfanyl-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
CID 2852882
2-Methoxy-N-(5-phenoxymethyl-[1,3,4]thiadiazol-2-yl)-acetamide
CID 652594
2-(2,4-Dimethyl-phenoxy)-N-(2-methyl-2H-tetrazol-5-yl)-acetamide
CID 654531
2-(2,4-dichlorophenoxy)-N-(2-ethyl-2H-tetrazol-5-yl)propanamide
CID 656072
N-(5-methyl-1,3,4-thiadiazol-2-yl)-2-phenoxyacetamide
CID 811240
2-phenoxy-N-(1H-tetrazol-5-yl)acetamide
CID 874260

Frequently Asked Questions

What is the IUPAC name of 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide?
The IUPAC name of 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide (CID 954295) is 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide.
What is the SMILES notation for 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide?
The canonical SMILES for 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide is CCCn1nnc(NC(=O)COc2ccccc2)n1.
What is the InChIKey of 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide?
The InChIKey is QXNVPPGBGKVGFJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H15N5O2/c1-2-8-17-15-12(14-16-17)13-11(18)9-19-10-6-4-3-5-7-10/h3-7H,2,8-9H2,1H3,(H,13,15,18).
What are the key properties of 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide?
2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide has a molecular weight of 261.28 g/mol, XLogP of 1.10, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-phenoxy-N-(2-propyltetrazol-5-yl)acetamide is sourced from PubChem (CID 954295), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).