2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid

C10H20N2O5 — CID 61418556

IUPAC2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid
SMILESCOCCN(CCOC)C(=O)N(C)CC(=O)O
InChIInChI=1S/C10H20N2O5/c1-11(8-9(13)14)10(15)12(4-6-16-2)5-7-17-3/h4-8H2,1-3H3,(H,13,14)
InChIKeySBPQGMAILBDIEZ-UHFFFAOYSA-N
MW248.28 g/mol
LogP-0.28
Rot. Bonds8

About 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid

2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid (PubChem CID 61418556) has the molecular formula C10H20N2O5 and a molecular weight of 248.28 g/mol. Its IUPAC name is 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid.

Molecular Properties

Compound Name2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid
PubChem CID61418556
Molecular FormulaC10H20N2O5
Molecular Weight248.28 g/mol
Exact Mass248.14
IUPAC Name2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid
SMILESCOCCN(CCOC)C(=O)N(C)CC(=O)O
InChIInChI=1S/C10H20N2O5/c1-11(8-9(13)14)10(15)12(4-6-16-2)5-7-17-3/h4-8H2,1-3H3,(H,13,14)
InChIKeySBPQGMAILBDIEZ-UHFFFAOYSA-N
XLogP-0.28
TPSA79.31 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.28
LogP ≤ 5-0.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid?
The IUPAC name of 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid (CID 61418556) is 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid.
What is the SMILES notation for 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid?
The canonical SMILES for 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid is COCCN(CCOC)C(=O)N(C)CC(=O)O.
What is the InChIKey of 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid?
The InChIKey is SBPQGMAILBDIEZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O5/c1-11(8-9(13)14)10(15)12(4-6-16-2)5-7-17-3/h4-8H2,1-3H3,(H,13,14).
What are the key properties of 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid?
2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid has a molecular weight of 248.28 g/mol, XLogP of -0.28, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[bis(2-methoxyethyl)carbamoyl-methylamino]acetic acid is sourced from PubChem (CID 61418556), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).