2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole

C16H17N3O2 — CID 23723253

IUPAC2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole
SMILESCCOc1ccccc1OCCn1nc2ccccc2n1
InChIInChI=1S/C16H17N3O2/c1-2-20-15-9-5-6-10-16(15)21-12-11-19-17-13-7-3-4-8-14(13)18-19/h3-10H,2,11-12H2,1H3
InChIKeyPFXZPWIHLVKRBB-UHFFFAOYSA-N
MW283.33 g/mol
LogP2.91
Rot. Bonds6

About 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole

2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole (PubChem CID 23723253) has the molecular formula C16H17N3O2 and a molecular weight of 283.33 g/mol. Its IUPAC name is 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole.

Molecular Properties

Compound Name2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole
PubChem CID23723253
Molecular FormulaC16H17N3O2
Molecular Weight283.33 g/mol
Exact Mass283.13
IUPAC Name2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole
SMILESCCOc1ccccc1OCCn1nc2ccccc2n1
InChIInChI=1S/C16H17N3O2/c1-2-20-15-9-5-6-10-16(15)21-12-11-19-17-13-7-3-4-8-14(13)18-19/h3-10H,2,11-12H2,1H3
InChIKeyPFXZPWIHLVKRBB-UHFFFAOYSA-N
XLogP2.91
TPSA49.17 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500283.33
LogP ≤ 52.91
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Related Compounds

1-[2-(2-methoxyphenoxy)ethyl]-1H-benzotriazole
CID 2986283
1-[2-(2-ethoxyphenoxy)ethyl]-1H-1,2,3-benzotriazole
CID 803394
2-[2-(2,4-dimethylphenoxy)ethyl]-2H-1,2,3-benzotriazole
CID 803812
2-(5,6-Dimethoxybenzotriazol-2-yl)aniline
CID 315157
2-(4-Methoxyphenyl)benzotriazole
CID 658624
1-[4-[2-(Benzotriazol-2-yl)ethoxy]phenoxy]-3-(propan-2-ylamino)propan-2-ol
CID 20205272
2-(2'-Methoxy-phenyl)-benztriazole
CID 12691726
Cambridge id 7004322
CID 803079
1-[2-(4-Ethoxyphenoxy)ethoxy]benzotriazole
CID 2491457
1-[2-(2-phenoxyethoxy)ethyl]-1H-1,2,3-benzotriazole
CID 2506464
2-[2-(2-phenoxyethoxy)ethyl]-2H-1,2,3-benzotriazole
CID 16614154
1-[4-(2-methoxyphenoxy)butyl]-1H-1,2,3-benzotriazole
CID 20425715

Frequently Asked Questions

What is the IUPAC name of 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole?
The IUPAC name of 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole (CID 23723253) is 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole.
What is the SMILES notation for 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole?
The canonical SMILES for 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole is CCOc1ccccc1OCCn1nc2ccccc2n1.
What is the InChIKey of 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole?
The InChIKey is PFXZPWIHLVKRBB-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H17N3O2/c1-2-20-15-9-5-6-10-16(15)21-12-11-19-17-13-7-3-4-8-14(13)18-19/h3-10H,2,11-12H2,1H3.
What are the key properties of 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole?
2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole has a molecular weight of 283.33 g/mol, XLogP of 2.91, 6 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[2-(2-ethoxyphenoxy)ethyl]benzotriazole is sourced from PubChem (CID 23723253), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).