1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

C18H24N2O — CID 134788957

IUPAC1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2C12CCN(CC1CCCCC1)C2
InChIInChI=1S/C18H24N2O/c21-17-18(15-8-4-5-9-16(15)19-17)10-11-20(13-18)12-14-6-2-1-3-7-14/h4-5,8-9,14H,1-3,6-7,10-13H2,(H,19,21)
InChIKeyCFMWXMRTRKFIPH-UHFFFAOYSA-N
MW284.40 g/mol
LogP3.16
Rot. Bonds2

About 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one

1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (PubChem CID 134788957) has the molecular formula C18H24N2O and a molecular weight of 284.40 g/mol. Its IUPAC name is 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.

Molecular Properties

Compound Name1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
PubChem CID134788957
Molecular FormulaC18H24N2O
Molecular Weight284.40 g/mol
Exact Mass284.19
IUPAC Name1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one
SMILESO=C1Nc2ccccc2C12CCN(CC1CCCCC1)C2
InChIInChI=1S/C18H24N2O/c21-17-18(15-8-4-5-9-16(15)19-17)10-11-20(13-18)12-14-6-2-1-3-7-14/h4-5,8-9,14H,1-3,6-7,10-13H2,(H,19,21)
InChIKeyCFMWXMRTRKFIPH-UHFFFAOYSA-N
XLogP3.16
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.40
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1'-ethylspiro[1H-indole-3,4'-piperidine]-2-one
CID 3042076
1'-(cyclohexylmethyl)-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
CID 134791375
1'-propylspiro[1H-indole-3,3'-pyrrolidine]-2-one;hydrochloride
CID 3042074
1-methyl-N-[(1R,3R)-3-[(2-oxospiro[1H-indole-3,4'-piperidine]-1'-yl)methyl]cyclohexyl]cyclopropane-1-carboxamide
CID 157012359
molecular hydrogen;spiro[1H-indole-3,1'-cyclobutane]-2-one
CID 145209538
1'-(2-methylpropyl)spiro[1H-indole-3,3'-piperidine]-2-one
CID 10199060
spiro[1H-indole-3,1'-cyclopropane]-2-one;hydrochloride
CID 141126988
1'-(7-bicyclo[4.2.0]oct-4-enylmethyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 70959217
1'-(oxetan-3-yl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 141437837
1'-(pyridin-2-ylmethyl)spiro[1H-indole-3,4'-piperidine]-2-one
CID 97375615
1'-(cyclopropylmethyl)-1-phenylspiro[indole-3,3'-pyrrolidine]-2-one
CID 134788995
2-oxospiro[1H-indole-3,3'-pyrrolidine]-1'-carboxamide
CID 154879377

Frequently Asked Questions

What is the IUPAC name of 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The IUPAC name of 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one (CID 134788957) is 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one.
What is the SMILES notation for 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The canonical SMILES for 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is O=C1Nc2ccccc2C12CCN(CC1CCCCC1)C2.
What is the InChIKey of 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
The InChIKey is CFMWXMRTRKFIPH-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H24N2O/c21-17-18(15-8-4-5-9-16(15)19-17)10-11-20(13-18)12-14-6-2-1-3-7-14/h4-5,8-9,14H,1-3,6-7,10-13H2,(H,19,21).
What are the key properties of 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one?
1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one has a molecular weight of 284.40 g/mol, XLogP of 3.16, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1'-(cyclohexylmethyl)spiro[1H-indole-3,3'-pyrrolidine]-2-one is sourced from PubChem (CID 134788957), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).