cyclopropyl(1H-indol-3-yl)methanone

C12H11NO — CID 965839

IUPACcyclopropyl(1H-indol-3-yl)methanone
SMILESO=C(c1c[nH]c2ccccc12)C1CC1
InChIInChI=1S/C12H11NO/c14-12(8-5-6-8)10-7-13-11-4-2-1-3-9(10)11/h1-4,7-8,13H,5-6H2
InChIKeyILBLOQDDOYEESV-UHFFFAOYSA-N
MW185.23 g/mol
LogP2.76
Rot. Bonds2

About cyclopropyl(1H-indol-3-yl)methanone

cyclopropyl(1H-indol-3-yl)methanone (PubChem CID 965839) has the molecular formula C12H11NO and a molecular weight of 185.23 g/mol. Its IUPAC name is cyclopropyl(1H-indol-3-yl)methanone.

Molecular Properties

Compound Namecyclopropyl(1H-indol-3-yl)methanone
PubChem CID965839
Molecular FormulaC12H11NO
Molecular Weight185.23 g/mol
Exact Mass185.08
IUPAC Namecyclopropyl(1H-indol-3-yl)methanone
SMILESO=C(c1c[nH]c2ccccc12)C1CC1
InChIInChI=1S/C12H11NO/c14-12(8-5-6-8)10-7-13-11-4-2-1-3-9(10)11/h1-4,7-8,13H,5-6H2
InChIKeyILBLOQDDOYEESV-UHFFFAOYSA-N
XLogP2.76
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500185.23
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Analyze cyclopropyl(1H-indol-3-yl)methanone 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

cyclopentyl(1H-indol-3-yl)methanone
CID 14069740
(3-aminocyclobutyl)-(1H-indol-3-yl)methanone
CID 116917713
1H-indol-3-yl(oxolan-3-yl)methanone
CID 61272977
1H-indol-3-yl(3-tricyclo[3.2.1.02,4]octanyl)methanone
CID 114096973
N,N-diethyl-4-(1H-indole-3-carbonyl)piperidine-1-carboxamide
CID 110643519
benzyl 4-(1H-indole-3-carbonyl)piperidine-1-carboxylate
CID 110643516
1H-indol-3-yl-[1-[(2-methylphenyl)methylsulfonyl]piperidin-4-yl]methanone
CID 110643540
cis-(1R,3S)-3-(1H-indole-3-carbonylamino)cyclopentane-1-carboxylic acid
CID 106320270
(1S,6R)-6-(1H-indole-3-carbonyl)cyclohex-3-ene-1-carboxylate
CID 11859762
2-[4-(1H-indole-3-carbonyl)piperidin-1-yl]sulfonylbenzonitrile
CID 110643547
1H-indole-3-carbonyl chloride;hydrochloride
CID 87937583
2-(4-chlorophenoxy)-1-[4-(1H-indole-3-carbonyl)piperidin-1-yl]ethanone
CID 110643500

Frequently Asked Questions

What is the IUPAC name of cyclopropyl(1H-indol-3-yl)methanone?
The IUPAC name of cyclopropyl(1H-indol-3-yl)methanone (CID 965839) is cyclopropyl(1H-indol-3-yl)methanone.
What is the SMILES notation for cyclopropyl(1H-indol-3-yl)methanone?
The canonical SMILES for cyclopropyl(1H-indol-3-yl)methanone is O=C(c1c[nH]c2ccccc12)C1CC1.
What is the InChIKey of cyclopropyl(1H-indol-3-yl)methanone?
The InChIKey is ILBLOQDDOYEESV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11NO/c14-12(8-5-6-8)10-7-13-11-4-2-1-3-9(10)11/h1-4,7-8,13H,5-6H2.
What are the key properties of cyclopropyl(1H-indol-3-yl)methanone?
cyclopropyl(1H-indol-3-yl)methanone has a molecular weight of 185.23 g/mol, XLogP of 2.76, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl(1H-indol-3-yl)methanone is sourced from PubChem (CID 965839), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).