(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid

C10H15NO3 — CID 178194513

IUPAC(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid
SMILESCC(=O)NC1CC(C2C[C@H]2C(=O)O)C1
InChIInChI=1S/C10H15NO3/c1-5(12)11-7-2-6(3-7)8-4-9(8)10(13)14/h6-9H,2-4H2,1H3,(H,11,12)(H,13,14)/t6?,7?,8?,9-/m1/s1
InChIKeyOXQXEZJRUUKIEB-RLKGBJSKSA-N
MW197.23 g/mol
LogP0.62
Rot. Bonds3

About (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid

(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid (PubChem CID 178194513) has the molecular formula C10H15NO3 and a molecular weight of 197.23 g/mol. Its IUPAC name is (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid
PubChem CID178194513
Molecular FormulaC10H15NO3
Molecular Weight197.23 g/mol
Exact Mass197.11
IUPAC Name(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid
SMILESCC(=O)NC1CC(C2C[C@H]2C(=O)O)C1
InChIInChI=1S/C10H15NO3/c1-5(12)11-7-2-6(3-7)8-4-9(8)10(13)14/h6-9H,2-4H2,1H3,(H,11,12)(H,13,14)/t6?,7?,8?,9-/m1/s1
InChIKeyOXQXEZJRUUKIEB-RLKGBJSKSA-N
XLogP0.62
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500197.23
LogP ≤ 50.62
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(5R)-6-methyl-3-bicyclo[3.2.0]heptanyl]acetamide
CID 166848885
cis-(1R,3S)-3-acetamidocyclopentane-1-carboxylic acid
CID 106320767
trans-(1R,2R)-2-(4-methylcyclohexyl)cyclopropane-1-carboxylic acid
CID 124510186
N-(3,6-dimethylcycloheptyl)acetamide
CID 89468976
cis-(1S,2R)-2-cyclobutylcyclopropane-1-carboxylic acid
CID 95788683
N-[(5R,11S)-11-amino-5-tricyclo[5.3.1.03,9]undecanyl]acetamide
CID 90327918
cis-(1S,2R)-2-cyclohexylcyclopropane-1-carboxylic acid
CID 12992914
2-(azetidin-3-yl)cyclopropane-1-carboxylic acid
CID 55279783
N-[(2S,6R)-2,6-dimethylpiperidin-4-yl]acetamide
CID 59032904
N-[(3aR,5R,7aR)-2,3,3a,4,5,6,7,7a-octahydro-1H-inden-5-yl]acetamide
CID 131102398
N-(3-iodocyclobutyl)acetamide
CID 145126673
2-(4-propan-2-ylcyclohexyl)cyclopropane-1-carboxylic acid
CID 130542777

Frequently Asked Questions

What is the IUPAC name of (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid?
The IUPAC name of (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid (CID 178194513) is (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid.
What is the SMILES notation for (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid?
The canonical SMILES for (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid is CC(=O)NC1CC(C2C[C@H]2C(=O)O)C1.
What is the InChIKey of (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid?
The InChIKey is OXQXEZJRUUKIEB-RLKGBJSKSA-N. The full InChI is InChI=1S/C10H15NO3/c1-5(12)11-7-2-6(3-7)8-4-9(8)10(13)14/h6-9H,2-4H2,1H3,(H,11,12)(H,13,14)/t6?,7?,8?,9-/m1/s1.
What are the key properties of (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid?
(1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid has a molecular weight of 197.23 g/mol, XLogP of 0.62, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R)-2-(3-acetamidocyclobutyl)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 178194513), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).