1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid

C11H17NO3 — CID 107175545

IUPAC1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid
SMILESCC1CCCC1C(=O)N1CC(C(=O)O)C1
InChIInChI=1S/C11H17NO3/c1-7-3-2-4-9(7)10(13)12-5-8(6-12)11(14)15/h7-9H,2-6H2,1H3,(H,14,15)
InChIKeyUAFDPQHAYGUDOY-UHFFFAOYSA-N
MW211.26 g/mol
LogP0.97
Rot. Bonds2

About 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid

1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid (PubChem CID 107175545) has the molecular formula C11H17NO3 and a molecular weight of 211.26 g/mol. Its IUPAC name is 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid.

Molecular Properties

Compound Name1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid
PubChem CID107175545
Molecular FormulaC11H17NO3
Molecular Weight211.26 g/mol
Exact Mass211.12
IUPAC Name1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid
SMILESCC1CCCC1C(=O)N1CC(C(=O)O)C1
InChIInChI=1S/C11H17NO3/c1-7-3-2-4-9(7)10(13)12-5-8(6-12)11(14)15/h7-9H,2-6H2,1H3,(H,14,15)
InChIKeyUAFDPQHAYGUDOY-UHFFFAOYSA-N
XLogP0.97
TPSA57.61 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500211.26
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Analyze 1-(2-methylcyclopentanecarbonyl)azetidine-3-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-(2-methylcyclopentanecarbonyl)piperidine-3-carboxylic acid
CID 107175062
2-(3,4-dimethylpyrrolidine-1-carbonyl)cyclopentane-1-carboxylic acid
CID 103978927
2-[1-(2-methylcyclopentanecarbonyl)azetidin-3-yl]acetic acid
CID 107175580
2-methylcyclooctane-1-carboxylic acid
CID 21039885
1-(2,6-dimethylcyclohexyl)azetidine-3-carboxylic acid
CID 65072053
1-(cyclobutanecarbonyl)-4-methylpyrrolidine-3-carboxylic acid
CID 63721542
2-(3,3a,4,5,6,6a-hexahydro-1H-cyclopenta[c]pyrrole-2-carbonyl)cyclopentane-1-carboxylic acid
CID 103979074
(1S)-2-methylcyclohexane-1-carboxylic acid
CID 89206969
(3-amino-2-methylcyclohexyl)-(3,4-dimethylpyrrolidin-1-yl)methanone
CID 79186972
(3-cyclopropyl-3-hydroxyazetidin-1-yl)-(2-methylcyclopentyl)methanone
CID 103282581
2-methylcyclohexane-1-carboxylic acid;dihydrochloride
CID 90238967
[2-(bromomethyl)-6-methylmorpholin-4-yl]-(2-methylcyclopentyl)methanone
CID 107184501

Frequently Asked Questions

What is the IUPAC name of 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid?
The IUPAC name of 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid (CID 107175545) is 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid.
What is the SMILES notation for 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid?
The canonical SMILES for 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid is CC1CCCC1C(=O)N1CC(C(=O)O)C1.
What is the InChIKey of 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid?
The InChIKey is UAFDPQHAYGUDOY-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17NO3/c1-7-3-2-4-9(7)10(13)12-5-8(6-12)11(14)15/h7-9H,2-6H2,1H3,(H,14,15).
What are the key properties of 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid?
1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid has a molecular weight of 211.26 g/mol, XLogP of 0.97, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(2-methylcyclopentanecarbonyl)azetidine-3-carboxylic acid is sourced from PubChem (CID 107175545), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).