2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid

C9H17NO4 — CID 82838234

IUPAC2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid
SMILESCOCCNC(C(=O)O)C1CCCO1
InChIInChI=1S/C9H17NO4/c1-13-6-4-10-8(9(11)12)7-3-2-5-14-7/h7-8,10H,2-6H2,1H3,(H,11,12)
InChIKeyCSDKULOTMQZDLT-UHFFFAOYSA-N
MW203.24 g/mol
LogP-0.15
Rot. Bonds6

About 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid

2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid (PubChem CID 82838234) has the molecular formula C9H17NO4 and a molecular weight of 203.24 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid
PubChem CID82838234
Molecular FormulaC9H17NO4
Molecular Weight203.24 g/mol
Exact Mass203.12
IUPAC Name2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid
SMILESCOCCNC(C(=O)O)C1CCCO1
InChIInChI=1S/C9H17NO4/c1-13-6-4-10-8(9(11)12)7-3-2-5-14-7/h7-8,10H,2-6H2,1H3,(H,11,12)
InChIKeyCSDKULOTMQZDLT-UHFFFAOYSA-N
XLogP-0.15
TPSA67.79 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.24
LogP ≤ 5-0.15
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(2-methoxyethylamino)-2-(oxolan-2-yl)ethanol
CID 82837239
(2S)-2-(methoxycarbonylamino)-2-[(2S)-oxan-2-yl]acetic acid
CID 129392106
(1R)-N-(2-methoxyethyl)-1-[(2S)-oxolan-2-yl]-2-phenylethanamine
CID 125486090
4-methoxy-N-[1-(oxolan-2-yl)ethyl]butan-1-amine
CID 104531009
N-(2-methoxyethyl)oxolane-2-carboxamide
CID 4190232
methyl 2-cyclohexyl-2-(2-methoxyethylamino)acetate
CID 62540326
(2S)-2-(benzylamino)-2-[(2S)-oxan-2-yl]acetic acid
CID 129392115
2-[2-(diethylamino)ethylamino]-2-(oxolan-2-yl)acetamide
CID 82837527
N',N'-bis(2-methoxyethyl)-N-[1-(oxolan-2-yl)ethyl]ethane-1,2-diamine
CID 62561783
N-(2-methoxyethyl)-2-(oxolan-2-yl)acetamide
CID 110696561
N-[(4,5-dimethyl-1,3-thiazol-2-yl)-(oxolan-2-yl)methyl]-2-methoxyethanamine
CID 82837780
N-[2-(cyclopropylmethoxy)ethyl]-1-(oxolan-2-yl)ethanamine
CID 62599763

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid?
The IUPAC name of 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid (CID 82838234) is 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid.
What is the SMILES notation for 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid?
The canonical SMILES for 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid is COCCNC(C(=O)O)C1CCCO1.
What is the InChIKey of 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid?
The InChIKey is CSDKULOTMQZDLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO4/c1-13-6-4-10-8(9(11)12)7-3-2-5-14-7/h7-8,10H,2-6H2,1H3,(H,11,12).
What are the key properties of 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid?
2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid has a molecular weight of 203.24 g/mol, XLogP of -0.15, 6 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-2-(oxolan-2-yl)acetic acid is sourced from PubChem (CID 82838234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).