4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid

C11H17NO3 — CID 83835004

IUPAC4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid
SMILESO=C(O)C1COCCN1C1CCC2CC21
InChIInChI=1S/C11H17NO3/c13-11(14)10-6-15-4-3-12(10)9-2-1-7-5-8(7)9/h7-10H,1-6H2,(H,13,14)
InChIKeyNUIFCLBFWWAWOI-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.57
Rot. Bonds2

About 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid

4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid (PubChem CID 83835004) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid.

Molecular Properties

Compound Name4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid
PubChem CID83835004
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid
SMILESO=C(O)C1COCCN1C1CCC2CC21
InChIInChI=1S/C11H17NO3/c13-11(14)10-6-15-4-3-12(10)9-2-1-7-5-8(7)9/h7-10H,1-6H2,(H,13,14)
InChIKeyNUIFCLBFWWAWOI-UHFFFAOYSA-N
XLogP0.57
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-(2-methylcyclobutyl)morpholine-3-carboxylic acid
CID 130555378
2-[3-(cyclopropylcarbamoyl)morpholin-4-yl]cyclobutane-1-carboxylic acid
CID 83103021
2-[3-(propan-2-ylcarbamoyl)morpholin-4-yl]cyclobutane-1-carboxylic acid
CID 83103874
(3S)-4-chloromorpholine-3-carboxylic acid
CID 121451605
2-(2-bicyclo[3.1.0]hexanyl)-2-azabicyclo[2.1.1]hexane-5-carboxylic acid
CID 131002506
(3R)-4-methylmorpholine-3-carboxylic acid
CID 66864905
4-(3,3,5,5-tetramethylcyclohexyl)morpholine-3-carboxylic acid
CID 103961433
4-(disulfanyl)morpholine-3-carboxylic acid
CID 174164325
4-cyclopropylmorpholine-3-carboxamide
CID 67153953
4-[2-(aminomethyl)cyclopentyl]morpholine-3-carboxamide
CID 83101214
methyl 4-(2-hydroxycyclohexyl)morpholine-3-carboxylate
CID 104774968
4-(3-aminocyclopentyl)morpholine-3-carboxamide
CID 83095575

Frequently Asked Questions

What is the IUPAC name of 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid?
The IUPAC name of 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid (CID 83835004) is 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid.
What is the SMILES notation for 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid?
The canonical SMILES for 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid is O=C(O)C1COCCN1C1CCC2CC21.
What is the InChIKey of 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid?
The InChIKey is NUIFCLBFWWAWOI-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c13-11(14)10-6-15-4-3-12(10)9-2-1-7-5-8(7)9/h7-10H,1-6H2,(H,13,14).
What are the key properties of 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid?
4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 0.57, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-bicyclo[3.1.0]hexanyl)morpholine-3-carboxylic acid is sourced from PubChem (CID 83835004), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).