2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid

C10H19NO3 — CID 65457394

IUPAC2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)CC1CCC1
InChIInChI=1S/C10H19NO3/c1-14-6-5-11(8-10(12)13)7-9-3-2-4-9/h9H,2-8H2,1H3,(H,12,13)
InChIKeyYJHFKZIJBSVRAF-UHFFFAOYSA-N
MW201.27 g/mol
LogP0.82
Rot. Bonds7

About 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid

2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid (PubChem CID 65457394) has the molecular formula C10H19NO3 and a molecular weight of 201.27 g/mol. Its IUPAC name is 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid.

Molecular Properties

Compound Name2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid
PubChem CID65457394
Molecular FormulaC10H19NO3
Molecular Weight201.27 g/mol
Exact Mass201.14
IUPAC Name2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid
SMILESCOCCN(CC(=O)O)CC1CCC1
InChIInChI=1S/C10H19NO3/c1-14-6-5-11(8-10(12)13)7-9-3-2-4-9/h9H,2-8H2,1H3,(H,12,13)
InChIKeyYJHFKZIJBSVRAF-UHFFFAOYSA-N
XLogP0.82
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.27
LogP ≤ 50.82
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(3-cyclopentyl-2-hydroxypropyl)-(2-methoxyethyl)amino]acetic acid
CID 103159326
2-[(2-amino-2-oxoethyl)-(cyclobutylmethyl)amino]acetic acid
CID 107440783
2-[cyclopropylmethyl-[2-(diethylamino)ethyl]amino]acetic acid
CID 43656536
2-[(4-ethylcycloheptyl)-(2-methoxyethyl)amino]acetic acid
CID 65087606
2-[2-methoxyethyl-[2-(1-methylpiperidin-2-yl)ethyl]amino]acetic acid
CID 54969053
2-[cyclopentyl(cyclopentylmethyl)amino]acetic acid
CID 61342644
2-[2,3-dihydro-1-benzothiophen-3-ylmethyl(2-methoxyethyl)amino]acetic acid
CID 79221506
2-[2-[cyclopentyl(methyl)amino]ethylcarbamoyl-(2-methoxyethyl)amino]acetic acid
CID 79271649
2-[cyclobutylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79269687
2-[[cyclopentylmethyl(methyl)carbamoyl]-methylamino]acetic acid
CID 63656971
3-cyclopentyl-N,N-bis(2-methoxyethyl)propan-1-amine
CID 78870866
2-[cycloheptylcarbamoyl(2-methoxyethyl)amino]acetic acid
CID 79271342

Frequently Asked Questions

What is the IUPAC name of 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid?
The IUPAC name of 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid (CID 65457394) is 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid.
What is the SMILES notation for 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid?
The canonical SMILES for 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid is COCCN(CC(=O)O)CC1CCC1.
What is the InChIKey of 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid?
The InChIKey is YJHFKZIJBSVRAF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H19NO3/c1-14-6-5-11(8-10(12)13)7-9-3-2-4-9/h9H,2-8H2,1H3,(H,12,13).
What are the key properties of 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid?
2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid has a molecular weight of 201.27 g/mol, XLogP of 0.82, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclobutylmethyl(2-methoxyethyl)amino]acetic acid is sourced from PubChem (CID 65457394), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).