2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride

C16H21ClN2O — CID 119791586

IUPAC2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride
SMILESCl.O=C(CC1CCCN1)N1CC2(CC2)c2ccccc21
InChIInChI=1S/C16H20N2O.ClH/c19-15(10-12-4-3-9-17-12)18-11-16(7-8-16)13-5-1-2-6-14(13)18;/h1-2,5-6,12,17H,3-4,7-11H2;1H
InChIKeyCTOYPRKPVJCWDM-UHFFFAOYSA-N
MW292.81 g/mol
LogP2.63
Rot. Bonds2

About 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride

2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride (PubChem CID 119791586) has the molecular formula C16H21ClN2O and a molecular weight of 292.81 g/mol. Its IUPAC name is 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride.

Molecular Properties

Compound Name2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride
PubChem CID119791586
Molecular FormulaC16H21ClN2O
Molecular Weight292.81 g/mol
Exact Mass292.13
IUPAC Name2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride
SMILESCl.O=C(CC1CCCN1)N1CC2(CC2)c2ccccc21
InChIInChI=1S/C16H20N2O.ClH/c19-15(10-12-4-3-9-17-12)18-11-16(7-8-16)13-5-1-2-6-14(13)18;/h1-2,5-6,12,17H,3-4,7-11H2;1H
InChIKeyCTOYPRKPVJCWDM-UHFFFAOYSA-N
XLogP2.63
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500292.81
LogP ≤ 52.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride?
The IUPAC name of 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride (CID 119791586) is 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride.
What is the SMILES notation for 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride?
The canonical SMILES for 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride is Cl.O=C(CC1CCCN1)N1CC2(CC2)c2ccccc21.
What is the InChIKey of 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride?
The InChIKey is CTOYPRKPVJCWDM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O.ClH/c19-15(10-12-4-3-9-17-12)18-11-16(7-8-16)13-5-1-2-6-14(13)18;/h1-2,5-6,12,17H,3-4,7-11H2;1H.
What are the key properties of 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride?
2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride has a molecular weight of 292.81 g/mol, XLogP of 2.63, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-pyrrolidin-2-yl-1-spiro[2H-indole-3,1'-cyclopropane]-1-ylethanone;hydrochloride is sourced from PubChem (CID 119791586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).