2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide

C13H20N2O4 — CID 18870897

IUPAC2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(CCO)CCO
InChIInChI=1S/C13H20N2O4/c1-19-12-5-3-2-4-11(12)14-13(18)10-15(6-8-16)7-9-17/h2-5,16-17H,6-10H2,1H3,(H,14,18)
InChIKeyFQVUYTOSNULTAC-UHFFFAOYSA-N
MW268.31 g/mol
LogP-0.08
Rot. Bonds8

About 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide

2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide (PubChem CID 18870897) has the molecular formula C13H20N2O4 and a molecular weight of 268.31 g/mol. Its IUPAC name is 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide.

Molecular Properties

Compound Name2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide
PubChem CID18870897
Molecular FormulaC13H20N2O4
Molecular Weight268.31 g/mol
Exact Mass268.14
IUPAC Name2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide
SMILESCOc1ccccc1NC(=O)CN(CCO)CCO
InChIInChI=1S/C13H20N2O4/c1-19-12-5-3-2-4-11(12)14-13(18)10-15(6-8-16)7-9-17/h2-5,16-17H,6-10H2,1H3,(H,14,18)
InChIKeyFQVUYTOSNULTAC-UHFFFAOYSA-N
XLogP-0.08
TPSA82.03 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds8
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.31
LogP ≤ 5-0.08
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide?
The IUPAC name of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide (CID 18870897) is 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide.
What is the SMILES notation for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide?
The canonical SMILES for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide is COc1ccccc1NC(=O)CN(CCO)CCO.
What is the InChIKey of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide?
The InChIKey is FQVUYTOSNULTAC-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O4/c1-19-12-5-3-2-4-11(12)14-13(18)10-15(6-8-16)7-9-17/h2-5,16-17H,6-10H2,1H3,(H,14,18).
What are the key properties of 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide?
2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide has a molecular weight of 268.31 g/mol, XLogP of -0.08, 8 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-hydroxyethyl)amino]-N-(2-methoxyphenyl)acetamide is sourced from PubChem (CID 18870897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).