2-(4-cyclohexylmorpholin-2-yl)acetic acid

C12H21NO3 — CID 66433671

IUPAC2-(4-cyclohexylmorpholin-2-yl)acetic acid
SMILESO=C(O)CC1CN(C2CCCCC2)CCO1
InChIInChI=1S/C12H21NO3/c14-12(15)8-11-9-13(6-7-16-11)10-4-2-1-3-5-10/h10-11H,1-9H2,(H,14,15)
InChIKeyFIESWLNQFIBBRM-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.49
Rot. Bonds3

About 2-(4-cyclohexylmorpholin-2-yl)acetic acid

2-(4-cyclohexylmorpholin-2-yl)acetic acid (PubChem CID 66433671) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is 2-(4-cyclohexylmorpholin-2-yl)acetic acid.

Molecular Properties

Compound Name2-(4-cyclohexylmorpholin-2-yl)acetic acid
PubChem CID66433671
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Name2-(4-cyclohexylmorpholin-2-yl)acetic acid
SMILESO=C(O)CC1CN(C2CCCCC2)CCO1
InChIInChI=1S/C12H21NO3/c14-12(15)8-11-9-13(6-7-16-11)10-4-2-1-3-5-10/h10-11H,1-9H2,(H,14,15)
InChIKeyFIESWLNQFIBBRM-UHFFFAOYSA-N
XLogP1.49
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500227.30
LogP ≤ 51.49
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[4-(oxan-3-yl)morpholin-2-yl]acetic acid
CID 66432953
methyl 2-(4-cyclopentylmorpholin-2-yl)acetate
CID 115537752
(4-cyclohexylmorpholin-2-yl)methanol
CID 83831638
2-[4-(1-propylpiperidin-4-yl)morpholin-2-yl]acetic acid
CID 66434708
(4-cyclopentylmorpholin-2-yl)methanol
CID 45098591
2-(bromomethyl)-4-cyclohexylmorpholine
CID 82937177
2-(4-cyclohexylmorpholin-2-yl)ethanamine
CID 82284305
2-[4-(2,2-dimethylcyclopentyl)morpholin-2-yl]acetic acid
CID 79862286
2-(1-cycloheptylpiperidin-3-yl)acetic acid
CID 65060458
2-[4-(2,4-dimethylcyclohexyl)morpholin-2-yl]acetic acid
CID 66435669
2-(carbamoylamino)-N-[2-[(2R)-4-cycloheptylmorpholin-2-yl]ethyl]acetamide
CID 95221858
2-[(2R)-oxan-2-yl]acetic acid
CID 6556828

Frequently Asked Questions

What is the IUPAC name of 2-(4-cyclohexylmorpholin-2-yl)acetic acid?
The IUPAC name of 2-(4-cyclohexylmorpholin-2-yl)acetic acid (CID 66433671) is 2-(4-cyclohexylmorpholin-2-yl)acetic acid.
What is the SMILES notation for 2-(4-cyclohexylmorpholin-2-yl)acetic acid?
The canonical SMILES for 2-(4-cyclohexylmorpholin-2-yl)acetic acid is O=C(O)CC1CN(C2CCCCC2)CCO1.
What is the InChIKey of 2-(4-cyclohexylmorpholin-2-yl)acetic acid?
The InChIKey is FIESWLNQFIBBRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c14-12(15)8-11-9-13(6-7-16-11)10-4-2-1-3-5-10/h10-11H,1-9H2,(H,14,15).
What are the key properties of 2-(4-cyclohexylmorpholin-2-yl)acetic acid?
2-(4-cyclohexylmorpholin-2-yl)acetic acid has a molecular weight of 227.30 g/mol, XLogP of 1.49, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(4-cyclohexylmorpholin-2-yl)acetic acid is sourced from PubChem (CID 66433671), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).