1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]

C20H30N2 — CID 70957527

IUPAC1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
SMILESCc1ccc2c(c1)C1(CCN([C@H](C)C3CCCC3)CC1)CN2
InChIInChI=1S/C20H30N2/c1-15-7-8-19-18(13-15)20(14-21-19)9-11-22(12-10-20)16(2)17-5-3-4-6-17/h7-8,13,16-17,21H,3-6,9-12,14H2,1-2H3/t16-/m1/s1
InChIKeyRBKPMQKOYVNVEL-MRXNPFEDSA-N
MW298.47 g/mol
LogP4.33
Rot. Bonds2

About 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]

1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine] (PubChem CID 70957527) has the molecular formula C20H30N2 and a molecular weight of 298.47 g/mol. Its IUPAC name is 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine].

Molecular Properties

Compound Name1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
PubChem CID70957527
Molecular FormulaC20H30N2
Molecular Weight298.47 g/mol
Exact Mass298.24
IUPAC Name1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]
SMILESCc1ccc2c(c1)C1(CCN([C@H](C)C3CCCC3)CC1)CN2
InChIInChI=1S/C20H30N2/c1-15-7-8-19-18(13-15)20(14-21-19)9-11-22(12-10-20)16(2)17-5-3-4-6-17/h7-8,13,16-17,21H,3-6,9-12,14H2,1-2H3/t16-/m1/s1
InChIKeyRBKPMQKOYVNVEL-MRXNPFEDSA-N
XLogP4.33
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.47
LogP ≤ 54.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]?
The IUPAC name of 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine] (CID 70957527) is 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine].
What is the SMILES notation for 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]?
The canonical SMILES for 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine] is Cc1ccc2c(c1)C1(CCN([C@H](C)C3CCCC3)CC1)CN2.
What is the InChIKey of 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]?
The InChIKey is RBKPMQKOYVNVEL-MRXNPFEDSA-N. The full InChI is InChI=1S/C20H30N2/c1-15-7-8-19-18(13-15)20(14-21-19)9-11-22(12-10-20)16(2)17-5-3-4-6-17/h7-8,13,16-17,21H,3-6,9-12,14H2,1-2H3/t16-/m1/s1.
What are the key properties of 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine]?
1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine] has a molecular weight of 298.47 g/mol, XLogP of 4.33, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-[(1R)-1-cyclopentylethyl]-5-methylspiro[1,2-dihydroindole-3,4'-piperidine] is sourced from PubChem (CID 70957527), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).