2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide

C15H20N4O2 — CID 2128755

IUPAC2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide
SMILESO=C(COn1nnc2ccccc21)NCC1CCCCC1
InChIInChI=1S/C15H20N4O2/c20-15(16-10-12-6-2-1-3-7-12)11-21-19-14-9-5-4-8-13(14)17-18-19/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,16,20)
InChIKeyYNLNFSBVRYXRBG-UHFFFAOYSA-N
MW288.35 g/mol
LogP1.56
Rot. Bonds5

About 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide

2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide (PubChem CID 2128755) has the molecular formula C15H20N4O2 and a molecular weight of 288.35 g/mol. Its IUPAC name is 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide.

Molecular Properties

Compound Name2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide
PubChem CID2128755
Molecular FormulaC15H20N4O2
Molecular Weight288.35 g/mol
Exact Mass288.16
IUPAC Name2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide
SMILESO=C(COn1nnc2ccccc21)NCC1CCCCC1
InChIInChI=1S/C15H20N4O2/c20-15(16-10-12-6-2-1-3-7-12)11-21-19-14-9-5-4-8-13(14)17-18-19/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,16,20)
InChIKeyYNLNFSBVRYXRBG-UHFFFAOYSA-N
XLogP1.56
TPSA69.04 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.35
LogP ≤ 51.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide?
The IUPAC name of 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide (CID 2128755) is 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide.
What is the SMILES notation for 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide?
The canonical SMILES for 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide is O=C(COn1nnc2ccccc21)NCC1CCCCC1.
What is the InChIKey of 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide?
The InChIKey is YNLNFSBVRYXRBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4O2/c20-15(16-10-12-6-2-1-3-7-12)11-21-19-14-9-5-4-8-13(14)17-18-19/h4-5,8-9,12H,1-3,6-7,10-11H2,(H,16,20).
What are the key properties of 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide?
2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide has a molecular weight of 288.35 g/mol, XLogP of 1.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(benzotriazol-1-yloxy)-N-(cyclohexylmethyl)acetamide is sourced from PubChem (CID 2128755), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).