spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride

C10H12ClN — CID 73424757

IUPACspiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride
SMILESCl.c1ccc2c(c1)NCC21CC1
InChIInChI=1S/C10H11N.ClH/c1-2-4-9-8(3-1)10(5-6-10)7-11-9;/h1-4,11H,5-7H2;1H
InChIKeyMYJKUISKKXRUIN-UHFFFAOYSA-N
MW181.67 g/mol
LogP2.57
Rot. Bonds

About spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride

spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride (PubChem CID 73424757) has the molecular formula C10H12ClN and a molecular weight of 181.67 g/mol. Its IUPAC name is spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride.

Molecular Properties

Compound Namespiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride
PubChem CID73424757
Molecular FormulaC10H12ClN
Molecular Weight181.67 g/mol
Exact Mass181.07
IUPAC Namespiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride
SMILESCl.c1ccc2c(c1)NCC21CC1
InChIInChI=1S/C10H11N.ClH/c1-2-4-9-8(3-1)10(5-6-10)7-11-9;/h1-4,11H,5-7H2;1H
InChIKeyMYJKUISKKXRUIN-UHFFFAOYSA-N
XLogP2.57
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500181.67
LogP ≤ 52.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride?
The IUPAC name of spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride (CID 73424757) is spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride.
What is the SMILES notation for spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride?
The canonical SMILES for spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride is Cl.c1ccc2c(c1)NCC21CC1.
What is the InChIKey of spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride?
The InChIKey is MYJKUISKKXRUIN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H11N.ClH/c1-2-4-9-8(3-1)10(5-6-10)7-11-9;/h1-4,11H,5-7H2;1H.
What are the key properties of spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride?
spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride has a molecular weight of 181.67 g/mol, XLogP of 2.57, 0 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydroindole-3,1'-cyclopropane];hydrochloride is sourced from PubChem (CID 73424757), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).