3-morpholin-4-ylpropanoic acid;hydrochloride

C7H14ClNO3 — CID 2760140

IUPAC3-morpholin-4-ylpropanoic acid;hydrochloride
SMILESCl.O=C(O)CCN1CCOCC1
InChIInChI=1S/C7H13NO3.ClH/c9-7(10)1-2-8-3-5-11-6-4-8;/h1-6H2,(H,9,10);1H
InChIKeyJLAHMPKUDAJSKA-UHFFFAOYSA-N
MW195.65 g/mol
LogP0.22
Rot. Bonds3

About 3-morpholin-4-ylpropanoic acid;hydrochloride

3-morpholin-4-ylpropanoic acid;hydrochloride (PubChem CID 2760140) has the molecular formula C7H14ClNO3 and a molecular weight of 195.65 g/mol. Its IUPAC name is 3-morpholin-4-ylpropanoic acid;hydrochloride.

Molecular Properties

Compound Name3-morpholin-4-ylpropanoic acid;hydrochloride
PubChem CID2760140
Molecular FormulaC7H14ClNO3
Molecular Weight195.65 g/mol
Exact Mass195.07
IUPAC Name3-morpholin-4-ylpropanoic acid;hydrochloride
SMILESCl.O=C(O)CCN1CCOCC1
InChIInChI=1S/C7H13NO3.ClH/c9-7(10)1-2-8-3-5-11-6-4-8;/h1-6H2,(H,9,10);1H
InChIKeyJLAHMPKUDAJSKA-UHFFFAOYSA-N
XLogP0.22
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500195.65
LogP ≤ 50.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

Ethyl 4-morpholinepropionate
CID 88374
4-Morpholinepropanoic acid, methyl ester
CID 101373
3-(Morpholin-4-yl)propanoic acid
CID 410813
2-Methyl-3-morpholin-4-ylpropanoic acid hydrochloride
CID 6603192
2-Methyl-3-morpholin-4-ylpropanoic acid
CID 652896
Methyl 3-morpholin-4-ylpropanoate;hydrochloride
CID 12425580
4-(2-Carboxyethyl)-4-morpholinium chloride
CID 129839277
2,2-Dimethyl-3-(morpholin-4-yl)propanoic acid hydrochloride
CID 126809365
(4-Methyl-3-morpholinyl)acetic acid hydrochloride
CID 137952070
3-(Morpholin-4-yl)butanoic acid
CID 20447262
2,2-Dimethyl-3-morpholinopropanoic acid
CID 21465515
Potassium 3-morpholin-4-ylpropanoate
CID 68439679

Frequently Asked Questions

What is the IUPAC name of 3-morpholin-4-ylpropanoic acid;hydrochloride?
The IUPAC name of 3-morpholin-4-ylpropanoic acid;hydrochloride (CID 2760140) is 3-morpholin-4-ylpropanoic acid;hydrochloride.
What is the SMILES notation for 3-morpholin-4-ylpropanoic acid;hydrochloride?
The canonical SMILES for 3-morpholin-4-ylpropanoic acid;hydrochloride is Cl.O=C(O)CCN1CCOCC1.
What is the InChIKey of 3-morpholin-4-ylpropanoic acid;hydrochloride?
The InChIKey is JLAHMPKUDAJSKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H13NO3.ClH/c9-7(10)1-2-8-3-5-11-6-4-8;/h1-6H2,(H,9,10);1H.
What are the key properties of 3-morpholin-4-ylpropanoic acid;hydrochloride?
3-morpholin-4-ylpropanoic acid;hydrochloride has a molecular weight of 195.65 g/mol, XLogP of 0.22, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-morpholin-4-ylpropanoic acid;hydrochloride is sourced from PubChem (CID 2760140), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).