N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide

C17H25N3O — CID 134805432

IUPACN-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide
SMILESCCNC(=O)c1ccc2c(c1)C1(CCCN(C)C1)CN2C
InChIInChI=1S/C17H25N3O/c1-4-18-16(21)13-6-7-15-14(10-13)17(12-20(15)3)8-5-9-19(2)11-17/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,18,21)
InChIKeyJINQBBIYOWEBKY-UHFFFAOYSA-N
MW287.41 g/mol
LogP1.85
Rot. Bonds2

About N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide

N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide (PubChem CID 134805432) has the molecular formula C17H25N3O and a molecular weight of 287.41 g/mol. Its IUPAC name is N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide.

Molecular Properties

Compound NameN-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide
PubChem CID134805432
Molecular FormulaC17H25N3O
Molecular Weight287.41 g/mol
Exact Mass287.20
IUPAC NameN-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide
SMILESCCNC(=O)c1ccc2c(c1)C1(CCCN(C)C1)CN2C
InChIInChI=1S/C17H25N3O/c1-4-18-16(21)13-6-7-15-14(10-13)17(12-20(15)3)8-5-9-19(2)11-17/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,18,21)
InChIKeyJINQBBIYOWEBKY-UHFFFAOYSA-N
XLogP1.85
TPSA35.58 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.41
LogP ≤ 51.85
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1,1'-dimethyl-N-(thiophen-2-ylmethyl)spiro[2H-indole-3,3'-piperidine]-5-carboxamide
CID 134806768
1,1'-dimethyl-N-(2-phenoxyethyl)spiro[2H-indole-3,3'-piperidine]-5-carboxamide
CID 134805058
1'-(2-methoxyethyl)-1-methyl-N-(2-phenoxyethyl)spiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134806758
N-ethyl-3-methyl-4-pyrrolidin-1-ylbenzamide
CID 168512289
4-amino-3-(2,2-dimethylpyrrolidin-1-yl)-N-ethylbenzamide
CID 55188948
1'-(2-methoxyethyl)-1-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134808150
N-(cyclopropylmethyl)-1'-methyl-1-[(2-methyl-1,3-thiazol-4-yl)methyl]spiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134809965
N-(3-hydroxypropyl)-1'-methyl-1-(oxan-4-ylmethyl)spiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134808469
N-ethyl-3-(ethylsulfamoyl)-4-(4-methylpiperazin-1-yl)benzamide
CID 99967029
1-(cyclopropylmethyl)-1'-methyl-N-phenylspiro[2H-indole-3,3'-pyrrolidine]-5-carboxamide
CID 134807365
methyl 4-(1,1'-dimethylspiro[2H-indole-3,3'-pyrrolidine]-5-yl)but-3-enoate
CID 162287123
N-hydroxy-1'-methylspiro[1,3-dihydroindene-2,3'-piperidine]-5-carboxamide
CID 138707615

Frequently Asked Questions

What is the IUPAC name of N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide?
The IUPAC name of N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide (CID 134805432) is N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide.
What is the SMILES notation for N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide?
The canonical SMILES for N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide is CCNC(=O)c1ccc2c(c1)C1(CCCN(C)C1)CN2C.
What is the InChIKey of N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide?
The InChIKey is JINQBBIYOWEBKY-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H25N3O/c1-4-18-16(21)13-6-7-15-14(10-13)17(12-20(15)3)8-5-9-19(2)11-17/h6-7,10H,4-5,8-9,11-12H2,1-3H3,(H,18,21).
What are the key properties of N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide?
N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide has a molecular weight of 287.41 g/mol, XLogP of 1.85, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-ethyl-1,1'-dimethylspiro[2H-indole-3,3'-piperidine]-5-carboxamide is sourced from PubChem (CID 134805432), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).