(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]

C18H24N2 — CID 141203199

IUPAC(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]
SMILESC[C@H]1CN([C@@H]2CCNC2)CC[C@@]12C=Cc1ccccc12
InChIInChI=1S/C18H24N2/c1-14-13-20(16-7-10-19-12-16)11-9-18(14)8-6-15-4-2-3-5-17(15)18/h2-6,8,14,16,19H,7,9-13H2,1H3/t14-,16+,18-/m0/s1
InChIKeyKWWNOUHWHYNILO-LESCRADOSA-N
MW268.40 g/mol
LogP2.65
Rot. Bonds1

About (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]

(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine] (PubChem CID 141203199) has the molecular formula C18H24N2 and a molecular weight of 268.40 g/mol. Its IUPAC name is (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine].

Molecular Properties

Compound Name(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]
PubChem CID141203199
Molecular FormulaC18H24N2
Molecular Weight268.40 g/mol
Exact Mass268.19
IUPAC Name(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]
SMILESC[C@H]1CN([C@@H]2CCNC2)CC[C@@]12C=Cc1ccccc12
InChIInChI=1S/C18H24N2/c1-14-13-20(16-7-10-19-12-16)11-9-18(14)8-6-15-4-2-3-5-17(15)18/h2-6,8,14,16,19H,7,9-13H2,1H3/t14-,16+,18-/m0/s1
InChIKeyKWWNOUHWHYNILO-LESCRADOSA-N
XLogP2.65
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.40
LogP ≤ 52.65
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]?
The IUPAC name of (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine] (CID 141203199) is (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine].
What is the SMILES notation for (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]?
The canonical SMILES for (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine] is C[C@H]1CN([C@@H]2CCNC2)CC[C@@]12C=Cc1ccccc12.
What is the InChIKey of (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]?
The InChIKey is KWWNOUHWHYNILO-LESCRADOSA-N. The full InChI is InChI=1S/C18H24N2/c1-14-13-20(16-7-10-19-12-16)11-9-18(14)8-6-15-4-2-3-5-17(15)18/h2-6,8,14,16,19H,7,9-13H2,1H3/t14-,16+,18-/m0/s1.
What are the key properties of (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine]?
(1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine] has a molecular weight of 268.40 g/mol, XLogP of 2.65, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (1R,3'R)-3'-methyl-1'-[(3R)-pyrrolidin-3-yl]spiro[indene-1,4'-piperidine] is sourced from PubChem (CID 141203199), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).