3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride

C8H16ClNO3 — CID 122163546

IUPAC3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride
SMILESCOCC1(C(=O)O)CCCNC1.Cl
InChIInChI=1S/C8H15NO3.ClH/c1-12-6-8(7(10)11)3-2-4-9-5-8;/h9H,2-6H2,1H3,(H,10,11);1H
InChIKeyUCWQOBXUFSEXQB-UHFFFAOYSA-N
MW209.67 g/mol
LogP0.51
Rot. Bonds3

About 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride

3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride (PubChem CID 122163546) has the molecular formula C8H16ClNO3 and a molecular weight of 209.67 g/mol. Its IUPAC name is 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride.

Molecular Properties

Compound Name3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride
PubChem CID122163546
Molecular FormulaC8H16ClNO3
Molecular Weight209.67 g/mol
Exact Mass209.08
IUPAC Name3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride
SMILESCOCC1(C(=O)O)CCCNC1.Cl
InChIInChI=1S/C8H15NO3.ClH/c1-12-6-8(7(10)11)3-2-4-9-5-8;/h9H,2-6H2,1H3,(H,10,11);1H
InChIKeyUCWQOBXUFSEXQB-UHFFFAOYSA-N
XLogP0.51
TPSA58.56 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500209.67
LogP ≤ 50.51
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(3R)-3-(methoxymethyl)pyrrolidine-3-carboxylic acid
CID 124593028
3-(4-methoxybutyl)piperidine-3-carboxylic acid
CID 104648540
3-(aminomethyl)piperidine-3-carboxylic acid
CID 130939829
chloroethane;3-propylpiperidine-3-carboxylic acid
CID 158782961
3-(6-hydroxyhexyl)piperidine-3-carboxylic acid
CID 107704736
3-(3-methoxypropyl)pyrrolidine-3-carboxylic acid
CID 63141172
methyl 3-propylpiperidine-3-carboxylate
CID 56773807
3-fluoro-3-(methoxymethyl)piperidine
CID 112562901
1-[(3-methoxypropanoylamino)methyl]cyclopentane-1-carboxylic acid
CID 81362446
1-[[(2-methoxyacetyl)amino]methyl]cyclohexane-1-carboxylic acid
CID 115435584
4-[[(3-ethylpiperidine-3-carbonyl)amino]methyl]oxane-4-carboxylic acid
CID 115439984
3-[(2-fluoro-3-methoxyphenyl)methyl]piperidine-3-carboxylic acid
CID 104792796

Frequently Asked Questions

What is the IUPAC name of 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride?
The IUPAC name of 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride (CID 122163546) is 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride.
What is the SMILES notation for 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride?
The canonical SMILES for 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride is COCC1(C(=O)O)CCCNC1.Cl.
What is the InChIKey of 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride?
The InChIKey is UCWQOBXUFSEXQB-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO3.ClH/c1-12-6-8(7(10)11)3-2-4-9-5-8;/h9H,2-6H2,1H3,(H,10,11);1H.
What are the key properties of 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride?
3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride has a molecular weight of 209.67 g/mol, XLogP of 0.51, 3 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(methoxymethyl)piperidine-3-carboxylic acid;hydrochloride is sourced from PubChem (CID 122163546), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).