3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]

C24H21Cl — CID 166807935

IUPAC3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
SMILESCc1cc(Cl)ccc1-c1ccc2c(c1)-c1ccccc1C21CCCC1
InChIInChI=1S/C24H21Cl/c1-16-14-18(25)9-10-19(16)17-8-11-23-21(15-17)20-6-2-3-7-22(20)24(23)12-4-5-13-24/h2-3,6-11,14-15H,4-5,12-13H2,1H3
InChIKeySQEPGUYPMAURFU-UHFFFAOYSA-N
MW344.89 g/mol
LogP7.16
Rot. Bonds1

About 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]

3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] (PubChem CID 166807935) has the molecular formula C24H21Cl and a molecular weight of 344.89 g/mol. Its IUPAC name is 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene].

Molecular Properties

Compound Name3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
PubChem CID166807935
Molecular FormulaC24H21Cl
Molecular Weight344.89 g/mol
Exact Mass344.13
IUPAC Name3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
SMILESCc1cc(Cl)ccc1-c1ccc2c(c1)-c1ccccc1C21CCCC1
InChIInChI=1S/C24H21Cl/c1-16-14-18(25)9-10-19(16)17-8-11-23-21(15-17)20-6-2-3-7-22(20)24(23)12-4-5-13-24/h2-3,6-11,14-15H,4-5,12-13H2,1H3
InChIKeySQEPGUYPMAURFU-UHFFFAOYSA-N
XLogP7.16
TPSA0.00 Ų
H-Bond Donors
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms25
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500344.89
LogP ≤ 57.16
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 100

Analyze 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] 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

3'-(4-methylphenyl)spiro[cyclopentane-1,9'-fluorene]
CID 58389877
2-[3-(6'-chlorospiro[cyclohexane-1,9'-fluorene]-3'-yl)phenyl]-3,5,6-triphenylpyrazine
CID 162443853
4,6-diphenyl-2-(2-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)pyrimidine
CID 161402725
2,4-diphenyl-6-[3-(2-phenyl-4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]-1,3,5-triazine
CID 174327344
2-[3-(2-methyl-5-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]-4,6-diphenylpyrimidine
CID 174327618
16'-chlorospiro[cyclohexane-1,10'-pentacyclo[11.8.0.03,11.04,9.014,19]henicosa-1,3(11),4,6,8,12,14(19),15,17-nonaene]
CID 154947345
2'-(6-spiro[cyclopentane-1,9'-fluorene]-2'-ylnaphthalen-2-yl)spiro[cyclopentane-1,9'-fluorene]
CID 58814373
2'-phenylspiro[cyclohexane-1,9'-fluorene]
CID 123183554
2-[4-methyl-3-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]-4,6-diphenylpyridine
CID 174327847
2,4,6-tri(spiro[cyclopentane-1,9'-fluorene]-2'-yl)pyrimidine
CID 71215635
2-[4-[4-(6',6'-dimethylspiro[cyclohexane-1,12'-indeno[1,2-b]fluorene]-3'-yl)phenyl]phenyl]-3,5,6-triphenylpyrazine
CID 166902522
2-phenyl-4-(4-phenylphenyl)-6-[4-[3-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(3-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine;2-phenyl-4-(4-phenylphenyl)-6-[4-[4-(4-spiro[cyclohexane-1,9'-fluorene]-3'-ylphenyl)phenyl]phenyl]-1,3,5-triazine
CID 159202142

Frequently Asked Questions

What is the IUPAC name of 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The IUPAC name of 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] (CID 166807935) is 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene].
What is the SMILES notation for 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The canonical SMILES for 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] is Cc1cc(Cl)ccc1-c1ccc2c(c1)-c1ccccc1C21CCCC1.
What is the InChIKey of 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
The InChIKey is SQEPGUYPMAURFU-UHFFFAOYSA-N. The full InChI is InChI=1S/C24H21Cl/c1-16-14-18(25)9-10-19(16)17-8-11-23-21(15-17)20-6-2-3-7-22(20)24(23)12-4-5-13-24/h2-3,6-11,14-15H,4-5,12-13H2,1H3.
What are the key properties of 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene]?
3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] has a molecular weight of 344.89 g/mol, XLogP of 7.16, 1 rotatable bonds, 0 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3'-(4-chloro-2-methylphenyl)spiro[cyclopentane-1,9'-fluorene] is sourced from PubChem (CID 166807935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).