2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid

C11H20N2O3 — CID 123313424

IUPAC2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCNC(CN2CCOCC2)C1
InChIInChI=1S/C11H20N2O3/c14-11(15)9-1-2-12-10(7-9)8-13-3-5-16-6-4-13/h9-10,12H,1-8H2,(H,14,15)
InChIKeyGJYYTWZDVBJUOU-UHFFFAOYSA-N
MW228.29 g/mol
LogP-0.23
Rot. Bonds3

About 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid

2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid (PubChem CID 123313424) has the molecular formula C11H20N2O3 and a molecular weight of 228.29 g/mol. Its IUPAC name is 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid.

Molecular Properties

Compound Name2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid
PubChem CID123313424
Molecular FormulaC11H20N2O3
Molecular Weight228.29 g/mol
Exact Mass228.15
IUPAC Name2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid
SMILESO=C(O)C1CCNC(CN2CCOCC2)C1
InChIInChI=1S/C11H20N2O3/c14-11(15)9-1-2-12-10(7-9)8-13-3-5-16-6-4-13/h9-10,12H,1-8H2,(H,14,15)
InChIKeyGJYYTWZDVBJUOU-UHFFFAOYSA-N
XLogP-0.23
TPSA61.80 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.29
LogP ≤ 5-0.23
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

methyl 2-(morpholin-4-ylmethyl)piperidine-4-carboxylate
CID 66978618
4-[(4-methylpiperidin-2-yl)methyl]morpholine
CID 114421101
3-(morpholin-4-ylmethyl)cyclopentane-1-carboxylic acid
CID 83821302
4-[[(2S)-pyrrolidin-2-yl]methyl]morpholine;dihydrochloride
CID 122361110
[(2S,4S)-2-methylpiperidin-4-yl]-[2-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 120637820
[(2S,4S)-2-methylpiperidin-4-yl]-[4-(oxan-4-ylmethyl)piperazin-1-yl]methanone
CID 120637071
[(2S,4S)-2-methylpiperidin-4-yl]-[4-(oxan-4-ylmethyl)piperazin-1-yl]methanone;hydrochloride
CID 120637070
3-(pyrrolidin-1-ylmethyl)morpholine;dihydrochloride
CID 18915160
4-[(2-methylpyrrolidin-3-yl)methyl]-1,4-oxazepane
CID 79384136
(2-methylpyrrolidin-3-yl)-[4-(morpholin-4-ylmethyl)piperidin-1-yl]methanone
CID 79379397
2-(piperidin-1-ylmethyl)cyclopropane-1-carboxylic acid
CID 67187694
4-[(4-methoxypyrrolidin-2-yl)methyl]morpholine
CID 61214671

Frequently Asked Questions

What is the IUPAC name of 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid?
The IUPAC name of 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid (CID 123313424) is 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid.
What is the SMILES notation for 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid?
The canonical SMILES for 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid is O=C(O)C1CCNC(CN2CCOCC2)C1.
What is the InChIKey of 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid?
The InChIKey is GJYYTWZDVBJUOU-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H20N2O3/c14-11(15)9-1-2-12-10(7-9)8-13-3-5-16-6-4-13/h9-10,12H,1-8H2,(H,14,15).
What are the key properties of 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid?
2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid has a molecular weight of 228.29 g/mol, XLogP of -0.23, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(morpholin-4-ylmethyl)piperidine-4-carboxylic acid is sourced from PubChem (CID 123313424), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).