2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid

C10H21NO4 — CID 65067403

IUPAC2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid
SMILESCOCCC(C)N(CCOC)CC(=O)O
InChIInChI=1S/C10H21NO4/c1-9(4-6-14-2)11(5-7-15-3)8-10(12)13/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyNATNUQGZPZSZLK-UHFFFAOYSA-N
MW219.28 g/mol
LogP0.44
Rot. Bonds9

About 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid

2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid (PubChem CID 65067403) has the molecular formula C10H21NO4 and a molecular weight of 219.28 g/mol. Its IUPAC name is 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid
PubChem CID65067403
Molecular FormulaC10H21NO4
Molecular Weight219.28 g/mol
Exact Mass219.15
IUPAC Name2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid
SMILESCOCCC(C)N(CCOC)CC(=O)O
InChIInChI=1S/C10H21NO4/c1-9(4-6-14-2)11(5-7-15-3)8-10(12)13/h9H,4-8H2,1-3H3,(H,12,13)
InChIKeyNATNUQGZPZSZLK-UHFFFAOYSA-N
XLogP0.44
TPSA59.00 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500219.28
LogP ≤ 50.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-[4-methoxybutan-2-yl(methyl)amino]acetic acid
CID 65056386
2-[tert-butyl(4-methoxybutan-2-yl)amino]acetic acid
CID 79268714
2-[butan-2-yl(2-propan-2-yloxyethyl)amino]acetic acid
CID 61484904
2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]acetamide
CID 61072169
methyl 2-[2-methoxyethyl(1-methoxypropan-2-yl)amino]acetate
CID 61067688
2-[[1-(carbamoylamino)-1-oxopropan-2-yl]-(2-methoxyethyl)amino]acetic acid
CID 54968906
2-[[1-(cyclopropylamino)-1-oxopropan-2-yl]-(2-methoxyethyl)amino]acetic acid
CID 54968957
2-[butan-2-yl-[2-methoxyethyl(methyl)carbamoyl]amino]acetic acid
CID 61428242
2-[butan-2-yl-[2-(4-methoxyphenoxy)ethyl]amino]acetic acid
CID 60833895
2-[butan-2-yl-[ethyl(2-methoxyethyl)carbamoyl]amino]acetic acid
CID 54948701
2-[bis(2-methoxyethyl)carbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79272631
2-[5-methylhexan-2-yl(2-methylpropyl)amino]acetic acid
CID 65063808

Frequently Asked Questions

What is the IUPAC name of 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid (CID 65067403) is 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid is COCCC(C)N(CCOC)CC(=O)O.
What is the InChIKey of 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid?
The InChIKey is NATNUQGZPZSZLK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H21NO4/c1-9(4-6-14-2)11(5-7-15-3)8-10(12)13/h9H,4-8H2,1-3H3,(H,12,13).
What are the key properties of 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid?
2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid has a molecular weight of 219.28 g/mol, XLogP of 0.44, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-methoxybutan-2-yl(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 65067403), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).