2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride

C10H21ClN2O2S — CID 119790691

IUPAC2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCC1CCCS1.Cl
InChIInChI=1S/C10H20N2O2S.ClH/c1-14-5-4-11-8-10(13)12-7-9-3-2-6-15-9;/h9,11H,2-8H2,1H3,(H,12,13);1H
InChIKeyNRURWBXORIQKFW-UHFFFAOYSA-N
MW268.81 g/mol
LogP0.66
Rot. Bonds7

About 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride

2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride (PubChem CID 119790691) has the molecular formula C10H21ClN2O2S and a molecular weight of 268.81 g/mol. Its IUPAC name is 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride.

Molecular Properties

Compound Name2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride
PubChem CID119790691
Molecular FormulaC10H21ClN2O2S
Molecular Weight268.81 g/mol
Exact Mass268.10
IUPAC Name2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride
SMILESCOCCNCC(=O)NCC1CCCS1.Cl
InChIInChI=1S/C10H20N2O2S.ClH/c1-14-5-4-11-8-10(13)12-7-9-3-2-6-15-9;/h9,11H,2-8H2,1H3,(H,12,13);1H
InChIKeyNRURWBXORIQKFW-UHFFFAOYSA-N
XLogP0.66
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.81
LogP ≤ 50.66
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-(cyclopropylmethylamino)-N-(thian-2-ylmethyl)acetamide
CID 80600083
2-(methylamino)-N-(thiolan-2-ylmethyl)acetamide
CID 80584517
N-propyl-2-(thiolan-2-ylmethylamino)acetamide
CID 80585576
N-[(4-ethylcyclohexyl)methyl]-2-(2-methoxyethylamino)acetamide;hydrochloride
CID 119743684
2-(2-methoxyethylamino)-N-(oxolan-2-ylmethyl)acetamide;hydrochloride
CID 119670121
2-(prop-2-ynylamino)-N-(thian-2-ylmethyl)acetamide
CID 80600284
2-(2-methoxyethylamino)-N-[(5-oxopyrrolidin-2-yl)methyl]acetamide
CID 79282461
2-amino-N-[2-oxo-2-(thiolan-2-ylmethylamino)ethyl]acetamide
CID 80584787
2-cyclohexyl-N-[2-[[2-(2-methoxyethylamino)acetyl]amino]ethyl]acetamide;hydrochloride
CID 119766819
2-(2-methoxyethylamino)-N-(oxan-2-ylmethyl)acetamide
CID 79281834
2-[[[2-(2-methoxyethylamino)acetyl]amino]methyl]cyclohexane-1-carboxylic acid
CID 79290747
N-ethyl-2-(thian-2-ylmethylamino)acetamide
CID 80600619

Frequently Asked Questions

What is the IUPAC name of 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride?
The IUPAC name of 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride (CID 119790691) is 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride.
What is the SMILES notation for 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride?
The canonical SMILES for 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride is COCCNCC(=O)NCC1CCCS1.Cl.
What is the InChIKey of 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride?
The InChIKey is NRURWBXORIQKFW-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H20N2O2S.ClH/c1-14-5-4-11-8-10(13)12-7-9-3-2-6-15-9;/h9,11H,2-8H2,1H3,(H,12,13);1H.
What are the key properties of 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride?
2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride has a molecular weight of 268.81 g/mol, XLogP of 0.66, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-methoxyethylamino)-N-(thiolan-2-ylmethyl)acetamide;hydrochloride is sourced from PubChem (CID 119790691), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).