spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone

C17H18N2OS — CID 97399955

IUPACspiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone
SMILESO=C(c1ccsc1)N1CCC2(CC1)CNc1ccccc12
InChIInChI=1S/C17H18N2OS/c20-16(13-5-10-21-11-13)19-8-6-17(7-9-19)12-18-15-4-2-1-3-14(15)17/h1-5,10-11,18H,6-9,12H2
InChIKeyVENUHYIZXVDQPZ-UHFFFAOYSA-N
MW298.41 g/mol
LogP3.35
Rot. Bonds1

About spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone

spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone (PubChem CID 97399955) has the molecular formula C17H18N2OS and a molecular weight of 298.41 g/mol. Its IUPAC name is spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone.

Molecular Properties

Compound Namespiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone
PubChem CID97399955
Molecular FormulaC17H18N2OS
Molecular Weight298.41 g/mol
Exact Mass298.11
IUPAC Namespiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone
SMILESO=C(c1ccsc1)N1CCC2(CC1)CNc1ccccc12
InChIInChI=1S/C17H18N2OS/c20-16(13-5-10-21-11-13)19-8-6-17(7-9-19)12-18-15-4-2-1-3-14(15)17/h1-5,10-11,18H,6-9,12H2
InChIKeyVENUHYIZXVDQPZ-UHFFFAOYSA-N
XLogP3.35
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500298.41
LogP ≤ 53.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

pyrrolidin-1-yl(spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl)methanone
CID 67667343
ethane;phosphanyl(spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl)methanone
CID 143386492
2-methoxy-1-spiro[1,2-dihydroindole-3,4'-piperidine]-1'-ylethanone
CID 166286568
9-(thiophene-3-carbonyl)-2,9-diazaspiro[5.5]undecan-3-one
CID 131680253
oxolan-2-yl(spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl)methanone
CID 86284648
6-ethyl-5-(spiro[1,2-dihydroindole-3,4'-piperidine]-1'-carbonyl)-1H-pyridin-2-one
CID 162629513
N-methyl-2-[1'-(thiophene-3-carbonyl)spiro[1,2-dihydroindene-3,4'-piperidine]-1-yl]acetamide
CID 131642110
(6-methyl-1H-indol-2-yl)-spiro[1,2-dihydroindole-3,4'-piperidine]-1'-ylmethanone
CID 167830899
8-benzoyl-2-thiophen-3-yl-2,8-diazaspiro[4.5]decan-1-one
CID 131688555
(4-methyl-1-benzofuran-2-yl)-spiro[1,2-dihydroindole-3,4'-piperidine]-1'-ylmethanone
CID 167825931
spiro[3,4-dihydrochromene-2,4'-piperidine]-1'-yl(thiophen-3-yl)methanone
CID 90565729
2-methyl-9-(thiophene-3-carbonyl)-2,9-diazaspiro[4.6]undecan-1-one
CID 131680090

Frequently Asked Questions

What is the IUPAC name of spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone?
The IUPAC name of spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone (CID 97399955) is spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone.
What is the SMILES notation for spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone?
The canonical SMILES for spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone is O=C(c1ccsc1)N1CCC2(CC1)CNc1ccccc12.
What is the InChIKey of spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone?
The InChIKey is VENUHYIZXVDQPZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2OS/c20-16(13-5-10-21-11-13)19-8-6-17(7-9-19)12-18-15-4-2-1-3-14(15)17/h1-5,10-11,18H,6-9,12H2.
What are the key properties of spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone?
spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone has a molecular weight of 298.41 g/mol, XLogP of 3.35, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for spiro[1,2-dihydroindole-3,4'-piperidine]-1'-yl(thiophen-3-yl)methanone is sourced from PubChem (CID 97399955), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).