1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one

C21H31N3O2 — CID 56895106

IUPAC1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one
SMILESCN1C(=O)C2(CCCN(CC(C)(C)N3CCOCC3)C2)c2ccccc21
InChIInChI=1S/C21H31N3O2/c1-20(2,24-11-13-26-14-12-24)15-23-10-6-9-21(16-23)17-7-4-5-8-18(17)22(3)19(21)25/h4-5,7-8H,6,9-16H2,1-3H3
InChIKeyVJJZBJCONNDPTL-UHFFFAOYSA-N
MW357.50 g/mol
LogP2.11
Rot. Bonds3

About 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one

1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one (PubChem CID 56895106) has the molecular formula C21H31N3O2 and a molecular weight of 357.50 g/mol. Its IUPAC name is 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one.

Molecular Properties

Compound Name1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one
PubChem CID56895106
Molecular FormulaC21H31N3O2
Molecular Weight357.50 g/mol
Exact Mass357.24
IUPAC Name1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one
SMILESCN1C(=O)C2(CCCN(CC(C)(C)N3CCOCC3)C2)c2ccccc21
InChIInChI=1S/C21H31N3O2/c1-20(2,24-11-13-26-14-12-24)15-23-10-6-9-21(16-23)17-7-4-5-8-18(17)22(3)19(21)25/h4-5,7-8H,6,9-16H2,1-3H3
InChIKeyVJJZBJCONNDPTL-UHFFFAOYSA-N
XLogP2.11
TPSA36.02 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.50
LogP ≤ 52.11
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one?
The IUPAC name of 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one (CID 56895106) is 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one.
What is the SMILES notation for 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one?
The canonical SMILES for 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one is CN1C(=O)C2(CCCN(CC(C)(C)N3CCOCC3)C2)c2ccccc21.
What is the InChIKey of 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one?
The InChIKey is VJJZBJCONNDPTL-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H31N3O2/c1-20(2,24-11-13-26-14-12-24)15-23-10-6-9-21(16-23)17-7-4-5-8-18(17)22(3)19(21)25/h4-5,7-8H,6,9-16H2,1-3H3.
What are the key properties of 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one?
1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one has a molecular weight of 357.50 g/mol, XLogP of 2.11, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-1'-(2-methyl-2-morpholin-4-ylpropyl)spiro[indole-3,3'-piperidine]-2-one is sourced from PubChem (CID 56895106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).