1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid

C12H21NO3 — CID 82235402

IUPAC1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid
SMILESCC1(C)COCCN1C1(C(=O)O)CCCC1
InChIInChI=1S/C12H21NO3/c1-11(2)9-16-8-7-13(11)12(10(14)15)5-3-4-6-12/h3-9H2,1-2H3,(H,14,15)
InChIKeyBUGBIJFNBMOAGD-UHFFFAOYSA-N
MW227.30 g/mol
LogP1.49
Rot. Bonds2

About 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid

1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid (PubChem CID 82235402) has the molecular formula C12H21NO3 and a molecular weight of 227.30 g/mol. Its IUPAC name is 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid.

Molecular Properties

Compound Name1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid
PubChem CID82235402
Molecular FormulaC12H21NO3
Molecular Weight227.30 g/mol
Exact Mass227.15
IUPAC Name1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid
SMILESCC1(C)COCCN1C1(C(=O)O)CCCC1
InChIInChI=1S/C12H21NO3/c1-11(2)9-16-8-7-13(11)12(10(14)15)5-3-4-6-12/h3-9H2,1-2H3,(H,14,15)
InChIKeyBUGBIJFNBMOAGD-UHFFFAOYSA-N
XLogP1.49
TPSA49.77 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
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

Analyze 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(3,3-dimethylmorpholin-4-yl)methyl]cyclopentane-1-carboxylic acid
CID 62271993
1-morpholin-4-ylcyclohexane-1-carboxylic acid;hydrochloride
CID 66545433
3-(azetidin-1-yl)oxolane-3-carboxylic acid
CID 84765930
3-[(3,3-dimethylmorpholin-4-yl)methyl]oxane-3-carboxylic acid
CID 55242826
1-[(3,3-dimethylmorpholine-4-carbonyl)amino]cyclobutane-1-carboxylic acid
CID 81162950
[1-(3,3-dimethylmorpholin-4-yl)-2,2-dimethylcyclohexyl]methanamine
CID 79847900
1-(3,3-dimethylmorpholine-4-carbonyl)-4-methylpiperidine-4-carboxylic acid
CID 63124235
8-morpholin-4-ylspiro[4.5]decane-8-carboxylic acid
CID 114819765
4-[(3,3-dimethylmorpholine-4-carbonyl)amino]oxane-4-carboxylic acid
CID 115292950
1-(3,3-dimethylmorpholine-4-carbonyl)-4-ethylpiperidine-4-carboxylic acid
CID 63127056
[1-(3,3-dimethylmorpholin-4-yl)-2,2-dimethylcyclopentyl]methanamine
CID 79857901
(3,3-dimethylmorpholin-4-yl)-piperidin-1-ylmethanone
CID 115592934

Frequently Asked Questions

What is the IUPAC name of 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid?
The IUPAC name of 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid (CID 82235402) is 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid.
What is the SMILES notation for 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid?
The canonical SMILES for 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid is CC1(C)COCCN1C1(C(=O)O)CCCC1.
What is the InChIKey of 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid?
The InChIKey is BUGBIJFNBMOAGD-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H21NO3/c1-11(2)9-16-8-7-13(11)12(10(14)15)5-3-4-6-12/h3-9H2,1-2H3,(H,14,15).
What are the key properties of 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid?
1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid has a molecular weight of 227.30 g/mol, XLogP of 1.49, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3,3-dimethylmorpholin-4-yl)cyclopentane-1-carboxylic acid is sourced from PubChem (CID 82235402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).