4-(2-methylcyclopentyl)morpholine-2-carboxylic acid

C11H19NO3 — CID 65067428

IUPAC4-(2-methylcyclopentyl)morpholine-2-carboxylic acid
SMILESCC1CCCC1N1CCOC(C(=O)O)C1
InChIInChI=1S/C11H19NO3/c1-8-3-2-4-9(8)12-5-6-15-10(7-12)11(13)14/h8-10H,2-7H2,1H3,(H,13,14)
InChIKeyCWBMCLZYYZJJES-UHFFFAOYSA-N
MW213.28 g/mol
LogP0.96
Rot. Bonds2

About 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid

4-(2-methylcyclopentyl)morpholine-2-carboxylic acid (PubChem CID 65067428) has the molecular formula C11H19NO3 and a molecular weight of 213.28 g/mol. Its IUPAC name is 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid.

Molecular Properties

Compound Name4-(2-methylcyclopentyl)morpholine-2-carboxylic acid
PubChem CID65067428
Molecular FormulaC11H19NO3
Molecular Weight213.28 g/mol
Exact Mass213.14
IUPAC Name4-(2-methylcyclopentyl)morpholine-2-carboxylic acid
SMILESCC1CCCC1N1CCOC(C(=O)O)C1
InChIInChI=1S/C11H19NO3/c1-8-3-2-4-9(8)12-5-6-15-10(7-12)11(13)14/h8-10H,2-7H2,1H3,(H,13,14)
InChIKeyCWBMCLZYYZJJES-UHFFFAOYSA-N
XLogP0.96
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.28
LogP ≤ 50.96
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid?
The IUPAC name of 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid (CID 65067428) is 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid.
What is the SMILES notation for 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid?
The canonical SMILES for 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid is CC1CCCC1N1CCOC(C(=O)O)C1.
What is the InChIKey of 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid?
The InChIKey is CWBMCLZYYZJJES-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19NO3/c1-8-3-2-4-9(8)12-5-6-15-10(7-12)11(13)14/h8-10H,2-7H2,1H3,(H,13,14).
What are the key properties of 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid?
4-(2-methylcyclopentyl)morpholine-2-carboxylic acid has a molecular weight of 213.28 g/mol, XLogP of 0.96, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(2-methylcyclopentyl)morpholine-2-carboxylic acid is sourced from PubChem (CID 65067428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).