2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide

C15H20N2O4 — CID 86907964

IUPAC2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide
SMILESCOCCN(CCOC)C(=O)Cc1noc2ccccc12
InChIInChI=1S/C15H20N2O4/c1-19-9-7-17(8-10-20-2)15(18)11-13-12-5-3-4-6-14(12)21-16-13/h3-6H,7-11H2,1-2H3
InChIKeyIDLIOQZFRCVZDC-UHFFFAOYSA-N
MW292.34 g/mol
LogP1.49
Rot. Bonds8

About 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide

2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide (PubChem CID 86907964) has the molecular formula C15H20N2O4 and a molecular weight of 292.34 g/mol. Its IUPAC name is 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide.

Molecular Properties

Compound Name2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide
PubChem CID86907964
Molecular FormulaC15H20N2O4
Molecular Weight292.34 g/mol
Exact Mass292.14
IUPAC Name2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide
SMILESCOCCN(CCOC)C(=O)Cc1noc2ccccc12
InChIInChI=1S/C15H20N2O4/c1-19-9-7-17(8-10-20-2)15(18)11-13-12-5-3-4-6-14(12)21-16-13/h3-6H,7-11H2,1-2H3
InChIKeyIDLIOQZFRCVZDC-UHFFFAOYSA-N
XLogP1.49
TPSA64.80 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.34
LogP ≤ 51.49
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide?
The IUPAC name of 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide (CID 86907964) is 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide.
What is the SMILES notation for 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide?
The canonical SMILES for 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide is COCCN(CCOC)C(=O)Cc1noc2ccccc12.
What is the InChIKey of 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide?
The InChIKey is IDLIOQZFRCVZDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O4/c1-19-9-7-17(8-10-20-2)15(18)11-13-12-5-3-4-6-14(12)21-16-13/h3-6H,7-11H2,1-2H3.
What are the key properties of 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide?
2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide has a molecular weight of 292.34 g/mol, XLogP of 1.49, 8 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(1,2-benzoxazol-3-yl)-N,N-bis(2-methoxyethyl)acetamide is sourced from PubChem (CID 86907964), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).