[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone

C26H23ClN2O — CID 44757897

IUPAC[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone
SMILESO=C(C1CC12c1ccccc1-c1ccccc12)N1CCN(c2ccccc2Cl)CC1
InChIInChI=1S/C26H23ClN2O/c27-23-11-5-6-12-24(23)28-13-15-29(16-14-28)25(30)22-17-26(22)20-9-3-1-7-18(20)19-8-2-4-10-21(19)26/h1-12,22H,13-17H2
InChIKeyQMEBPRPZOLEMRY-UHFFFAOYSA-N
MW414.94 g/mol
LogP4.98
Rot. Bonds2

About [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone

[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone (PubChem CID 44757897) has the molecular formula C26H23ClN2O and a molecular weight of 414.94 g/mol. Its IUPAC name is [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone.

Molecular Properties

Compound Name[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone
PubChem CID44757897
Molecular FormulaC26H23ClN2O
Molecular Weight414.94 g/mol
Exact Mass414.15
IUPAC Name[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone
SMILESO=C(C1CC12c1ccccc1-c1ccccc12)N1CCN(c2ccccc2Cl)CC1
InChIInChI=1S/C26H23ClN2O/c27-23-11-5-6-12-24(23)28-13-15-29(16-14-28)25(30)22-17-26(22)20-9-3-1-7-18(20)19-8-2-4-10-21(19)26/h1-12,22H,13-17H2
InChIKeyQMEBPRPZOLEMRY-UHFFFAOYSA-N
XLogP4.98
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500414.94
LogP ≤ 54.98
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone 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

[4-(2-chlorophenyl)piperazin-1-yl]-piperidin-4-ylmethanone;dihydrochloride
CID 119827691
(4R)-4-[4-(2-chlorophenyl)piperazine-1-carbonyl]pyrrolidin-2-one
CID 129377317
[(1S,3R)-3-aminocyclopentyl]-[4-(2-chlorophenyl)piperazin-1-yl]methanone
CID 124523270
[(1R,2S)-2-aminocyclopentyl]-[4-(2-chlorophenyl)piperazin-1-yl]methanone
CID 124510897
[4-(2-chlorophenyl)piperazin-1-yl]-pyrrolidin-2-ylmethanone;hydrochloride
CID 18545111
3-[4-(2-chlorophenyl)piperazine-1-carbonyl]bicyclo[3.3.1]nonan-9-one
CID 4786854
[(1R)-2,2-dichlorocyclopropyl]-[4-(2-methoxyphenyl)piperazin-1-yl]methanone
CID 41024311
1-(2-chlorophenyl)-4-prop-1-en-2-ylpiperazine
CID 142506773
4-(2-chlorophenyl)-1,4-diazepane-1-carboxylic acid
CID 134498265
[4-(2-chlorophenyl)piperazin-1-yl]-[(3S)-2-methyl-2,8-diazaspiro[4.5]decan-3-yl]methanone
CID 95863111
[4-(2-chlorophenyl)piperazin-1-yl]-piperidin-3-ylmethanone;dihydrochloride
CID 119827676
[4-(3-chloro-4-pyridinyl)piperazin-1-yl]-[(1R)-2,2-dichlorocyclopropyl]methanone
CID 97242539

Frequently Asked Questions

What is the IUPAC name of [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone?
The IUPAC name of [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone (CID 44757897) is [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone.
What is the SMILES notation for [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone?
The canonical SMILES for [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone is O=C(C1CC12c1ccccc1-c1ccccc12)N1CCN(c2ccccc2Cl)CC1.
What is the InChIKey of [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone?
The InChIKey is QMEBPRPZOLEMRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C26H23ClN2O/c27-23-11-5-6-12-24(23)28-13-15-29(16-14-28)25(30)22-17-26(22)20-9-3-1-7-18(20)19-8-2-4-10-21(19)26/h1-12,22H,13-17H2.
What are the key properties of [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone?
[4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone has a molecular weight of 414.94 g/mol, XLogP of 4.98, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(2-chlorophenyl)piperazin-1-yl]-spiro[cyclopropane-2,9'-fluorene]-1-ylmethanone is sourced from PubChem (CID 44757897), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).