7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine

C11H12ClN — CID 105447762

IUPAC7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESNC1CC12CCc1c(Cl)cccc12
InChIInChI=1S/C11H12ClN/c12-9-3-1-2-8-7(9)4-5-11(8)6-10(11)13/h1-3,10H,4-6,13H2
InChIKeyHWUSRFQFFBAPNF-UHFFFAOYSA-N
MW193.68 g/mol
LogP2.26
Rot. Bonds

About 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine

7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (PubChem CID 105447762) has the molecular formula C11H12ClN and a molecular weight of 193.68 g/mol. Its IUPAC name is 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.

Molecular Properties

Compound Name7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
PubChem CID105447762
Molecular FormulaC11H12ClN
Molecular Weight193.68 g/mol
Exact Mass193.07
IUPAC Name7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESNC1CC12CCc1c(Cl)cccc12
InChIInChI=1S/C11H12ClN/c12-9-3-1-2-8-7(9)4-5-11(8)6-10(11)13/h1-3,10H,4-6,13H2
InChIKeyHWUSRFQFFBAPNF-UHFFFAOYSA-N
XLogP2.26
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.68
LogP ≤ 52.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The IUPAC name of 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (CID 105447762) is 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.
What is the SMILES notation for 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The canonical SMILES for 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is NC1CC12CCc1c(Cl)cccc12.
What is the InChIKey of 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The InChIKey is HWUSRFQFFBAPNF-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN/c12-9-3-1-2-8-7(9)4-5-11(8)6-10(11)13/h1-3,10H,4-6,13H2.
What are the key properties of 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine has a molecular weight of 193.68 g/mol, XLogP of 2.26, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 7-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is sourced from PubChem (CID 105447762), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).