1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one

C17H22N2O — CID 97400093

IUPAC1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one
SMILESCN1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12
InChIInChI=1S/C17H22N2O/c1-18-10-8-17(9-11-18)14-4-2-3-5-15(14)19(16(17)20)12-13-6-7-13/h2-5,13H,6-12H2,1H3
InChIKeySCDRGAKWCRVHMN-UHFFFAOYSA-N
MW270.38 g/mol
LogP2.41
Rot. Bonds2

About 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one

1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one (PubChem CID 97400093) has the molecular formula C17H22N2O and a molecular weight of 270.38 g/mol. Its IUPAC name is 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one.

Molecular Properties

Compound Name1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one
PubChem CID97400093
Molecular FormulaC17H22N2O
Molecular Weight270.38 g/mol
Exact Mass270.17
IUPAC Name1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one
SMILESCN1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12
InChIInChI=1S/C17H22N2O/c1-18-10-8-17(9-11-18)14-4-2-3-5-15(14)19(16(17)20)12-13-6-7-13/h2-5,13H,6-12H2,1H3
InChIKeySCDRGAKWCRVHMN-UHFFFAOYSA-N
XLogP2.41
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500270.38
LogP ≤ 52.41
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one?
The IUPAC name of 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one (CID 97400093) is 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one.
What is the SMILES notation for 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one?
The canonical SMILES for 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one is CN1CCC2(CC1)C(=O)N(CC1CC1)c1ccccc12.
What is the InChIKey of 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one?
The InChIKey is SCDRGAKWCRVHMN-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N2O/c1-18-10-8-17(9-11-18)14-4-2-3-5-15(14)19(16(17)20)12-13-6-7-13/h2-5,13H,6-12H2,1H3.
What are the key properties of 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one?
1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one has a molecular weight of 270.38 g/mol, XLogP of 2.41, 2 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopropylmethyl)-1'-methylspiro[indole-3,4'-piperidine]-2-one is sourced from PubChem (CID 97400093), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).