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

C11H12ClN — CID 105447763

IUPAC5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESNC1CC12CCc1ccc(Cl)cc12
InChIInChI=1S/C11H12ClN/c12-8-2-1-7-3-4-11(6-10(11)13)9(7)5-8/h1-2,5,10H,3-4,6,13H2
InChIKeyVVIREOZKRWANDG-UHFFFAOYSA-N
MW193.68 g/mol
LogP2.26
Rot. Bonds

About 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine

5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (PubChem CID 105447763) has the molecular formula C11H12ClN and a molecular weight of 193.68 g/mol. Its IUPAC name is 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.

Molecular Properties

Compound Name5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
PubChem CID105447763
Molecular FormulaC11H12ClN
Molecular Weight193.68 g/mol
Exact Mass193.07
IUPAC Name5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine
SMILESNC1CC12CCc1ccc(Cl)cc12
InChIInChI=1S/C11H12ClN/c12-8-2-1-7-3-4-11(6-10(11)13)9(7)5-8/h1-2,5,10H,3-4,6,13H2
InChIKeyVVIREOZKRWANDG-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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Related Compounds

2',3'-Dihydrospiro[cyclopropane-1,1'-indene]-3-amine
CID 62388829
trans-2-(4-Chlorophenyl)-2-fluorocyclopropanamine
CID 11241513
cis-2-(4-Chlorophenyl)-2-fluorocyclopropanamine
CID 11390419
2-(4-Chlorophenyl)-2-fluoro-cyclopropylamine
CID 44398212
[1-(4-Chlorophenyl)cyclopentyl]methanamine
CID 580778
(1-(4-Chlorophenyl)cyclopropyl)methanamine hydrochloride
CID 24213218
2-(4-Chlorophenyl)cyclopropanamine
CID 3017232
US10301253, Example 12
CID 105461411
US10301253, Example 24
CID 105461412
US10301253, Example 89
CID 122442949
US10301253, Example 77
CID 122463408
US10301253, Example 61
CID 122463441

Frequently Asked Questions

What is the IUPAC name of 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The IUPAC name of 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine (CID 105447763) is 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine.
What is the SMILES notation for 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The canonical SMILES for 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is NC1CC12CCc1ccc(Cl)cc12.
What is the InChIKey of 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
The InChIKey is VVIREOZKRWANDG-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H12ClN/c12-8-2-1-7-3-4-11(6-10(11)13)9(7)5-8/h1-2,5,10H,3-4,6,13H2.
What are the key properties of 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine?
5-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 5-chlorospiro[1,2-dihydroindene-3,2'-cyclopropane]-1'-amine is sourced from PubChem (CID 105447763), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).