4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]

C12H11BrN2 — CID 171568249

IUPAC4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]
SMILESBrc1c2c(cc3[nH]ncc13)CCC21CC1
InChIInChI=1S/C12H11BrN2/c13-11-8-6-14-15-9(8)5-7-1-2-12(3-4-12)10(7)11/h5-6H,1-4H2,(H,14,15)
InChIKeyRSZRKOLCJMEITM-UHFFFAOYSA-N
MW263.14 g/mol
LogP3.30
Rot. Bonds

About 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]

4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane] (PubChem CID 171568249) has the molecular formula C12H11BrN2 and a molecular weight of 263.14 g/mol. Its IUPAC name is 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane].

Molecular Properties

Compound Name4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]
PubChem CID171568249
Molecular FormulaC12H11BrN2
Molecular Weight263.14 g/mol
Exact Mass262.01
IUPAC Name4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]
SMILESBrc1c2c(cc3[nH]ncc13)CCC21CC1
InChIInChI=1S/C12H11BrN2/c13-11-8-6-14-15-9(8)5-7-1-2-12(3-4-12)10(7)11/h5-6H,1-4H2,(H,14,15)
InChIKeyRSZRKOLCJMEITM-UHFFFAOYSA-N
XLogP3.30
TPSA28.68 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.14
LogP ≤ 53.30
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

4-bromo-6-methyl-1H-benzo[f]indazole
CID 170195977
4-bromo-5,6-dichloro-1H-indazole
CID 139345853
4-bromo-6-fluoro-5-methyl-1H-indazole
CID 139508183
4,5-diazatricyclo[6.1.1.02,6]deca-1,3,6,8-tetraene
CID 174746798
16-(3-bromophenyl)-4,5,10-triazatetracyclo[7.7.0.02,6.011,15]hexadeca-1(9),2(6),3,7,11(15)-pentaen-14-one
CID 139214968
(5R)-4,5-diethyl-6,6-difluoro-1,5,7,8-tetrahydrobenzo[f]indazole
CID 177150249
4-bromo-6-chloro-1H-indazole-5-carbaldehyde
CID 171613711
4-bromo-5-methoxy-1H-indazole
CID 46941913
6-bromospiro[1,2-dihydroindene-3,1'-cyclopropane];ethane
CID 145339117
4-bromo-5-chloro-1H-pyrazolo[3,4-c]pyridine
CID 142474937
7-bromo-4,5-dihydro-1H-benzo[g]indazole
CID 91620026
5-bromospiro[1,2-dihydroindene-3,3'-azetidine]
CID 84629055

Frequently Asked Questions

What is the IUPAC name of 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]?
The IUPAC name of 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane] (CID 171568249) is 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane].
What is the SMILES notation for 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]?
The canonical SMILES for 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane] is Brc1c2c(cc3[nH]ncc13)CCC21CC1.
What is the InChIKey of 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]?
The InChIKey is RSZRKOLCJMEITM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11BrN2/c13-11-8-6-14-15-9(8)5-7-1-2-12(3-4-12)10(7)11/h5-6H,1-4H2,(H,14,15).
What are the key properties of 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane]?
4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane] has a molecular weight of 263.14 g/mol, XLogP of 3.30, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-bromospiro[6,7-dihydro-1H-cyclopenta[f]indazole-5,1'-cyclopropane] is sourced from PubChem (CID 171568249), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).