1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid

C18H15NO3 — CID 75418599

IUPAC1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
SMILESO=C(O)C1(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)CC1
InChIInChI=1S/C18H15NO3/c20-16(18(7-8-18)17(21)22)19-13-5-6-15-12(10-13)9-11-3-1-2-4-14(11)15/h1-6,10H,7-9H2,(H,19,20)(H,21,22)
InChIKeyHEJIIJFWBDGJSU-UHFFFAOYSA-N
MW293.32 g/mol
LogP3.06
Rot. Bonds3

About 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid

1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid (PubChem CID 75418599) has the molecular formula C18H15NO3 and a molecular weight of 293.32 g/mol. Its IUPAC name is 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid.

Molecular Properties

Compound Name1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
PubChem CID75418599
Molecular FormulaC18H15NO3
Molecular Weight293.32 g/mol
Exact Mass293.11
IUPAC Name1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid
SMILESO=C(O)C1(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)CC1
InChIInChI=1S/C18H15NO3/c20-16(18(7-8-18)17(21)22)19-13-5-6-15-12(10-13)9-11-3-1-2-4-14(11)15/h1-6,10H,7-9H2,(H,19,20)(H,21,22)
InChIKeyHEJIIJFWBDGJSU-UHFFFAOYSA-N
XLogP3.06
TPSA66.40 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500293.32
LogP ≤ 53.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'beta-keto/anhydride', 'substructure': 'N/A'}

Analyze 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-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-(aminomethyl)-N-(9H-fluoren-2-yl)cyclopropane-1-carboxamide
CID 80588288
N-(9H-fluoren-2-yl)-4-(methoxymethyl)piperidine-4-carboxamide
CID 120617190
[(2S)-1-(9H-fluoren-2-ylamino)-1-oxopropan-2-yl]azanium
CID 2220327
1-[(1,3-dioxoisoindol-5-yl)carbamoyl]cyclopropane-1-carboxylic acid
CID 62096392
1-(2,3-dihydro-1H-inden-5-ylcarbamoyl)cyclobutane-1-carboxylic acid
CID 62095213
N-(9H-fluoren-2-ylcarbamothioyl)acetamide
CID 17099951
2-(4-acetamidophenyl)-N-(9H-fluoren-2-yl)acetamide
CID 30755196
N-(9H-fluoren-2-yl)pyridine-2-carboxamide
CID 24637018
N-(9H-fluoren-2-yl)-2-(phenylcarbamoylamino)acetamide
CID 24583638
(2S)-2-amino-4-(9H-fluoren-2-ylamino)-4-oxobutanoic acid
CID 11369932
N-(9H-fluoren-2-yl)-2,2-dimethyl-3-(2-methylprop-1-enyl)cyclopropane-1-carboxamide
CID 17139231
2-(9H-fluoren-2-ylamino)cyclobutane-1-carboxylic acid
CID 103232769

Frequently Asked Questions

What is the IUPAC name of 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid?
The IUPAC name of 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid (CID 75418599) is 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid.
What is the SMILES notation for 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid?
The canonical SMILES for 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid is O=C(O)C1(C(=O)Nc2ccc3c(c2)Cc2ccccc2-3)CC1.
What is the InChIKey of 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid?
The InChIKey is HEJIIJFWBDGJSU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H15NO3/c20-16(18(7-8-18)17(21)22)19-13-5-6-15-12(10-13)9-11-3-1-2-4-14(11)15/h1-6,10H,7-9H2,(H,19,20)(H,21,22).
What are the key properties of 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid?
1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid has a molecular weight of 293.32 g/mol, XLogP of 3.06, 3 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(9H-fluoren-2-ylcarbamoyl)cyclopropane-1-carboxylic acid is sourced from PubChem (CID 75418599), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).