N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide

C21H23N3O2S — CID 47083781

IUPACN-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESCCn1ccc2cc(NC(=O)C3CCCN(C(=O)c4cccs4)C3)ccc21
InChIInChI=1S/C21H23N3O2S/c1-2-23-11-9-15-13-17(7-8-18(15)23)22-20(25)16-5-3-10-24(14-16)21(26)19-6-4-12-27-19/h4,6-9,11-13,16H,2-3,5,10,14H2,1H3,(H,22,25)
InChIKeyUIRPQINDSGYLNI-UHFFFAOYSA-N
MW381.50 g/mol
LogP4.21
Rot. Bonds4

About N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide

N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (PubChem CID 47083781) has the molecular formula C21H23N3O2S and a molecular weight of 381.50 g/mol. Its IUPAC name is N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.

Molecular Properties

Compound NameN-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
PubChem CID47083781
Molecular FormulaC21H23N3O2S
Molecular Weight381.50 g/mol
Exact Mass381.15
IUPAC NameN-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
SMILESCCn1ccc2cc(NC(=O)C3CCCN(C(=O)c4cccs4)C3)ccc21
InChIInChI=1S/C21H23N3O2S/c1-2-23-11-9-15-13-17(7-8-18(15)23)22-20(25)16-5-3-10-24(14-16)21(26)19-6-4-12-27-19/h4,6-9,11-13,16H,2-3,5,10,14H2,1H3,(H,22,25)
InChIKeyUIRPQINDSGYLNI-UHFFFAOYSA-N
XLogP4.21
TPSA54.34 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500381.50
LogP ≤ 54.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(3,4-dichlorophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946658
N-(4-bromophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946615
N-(4-propan-2-ylphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946825
N-[3-(pyrrolidine-1-carbonyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42955485
N-[4-(diethylsulfamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42946763
N-[4-(4-ethoxyphenoxy)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 46557429
N-[4-(2-methyl-1,3-thiazol-4-yl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 42947029
N-[4-(cyanomethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55558619
(3S)-N-propyl-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 39977852
N-(3-cyclopentyloxy-4-methoxyphenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55584917
N-[4-(dimethylsulfamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 55560044
N-(4-fluoro-3-nitrophenyl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide
CID 134034204

Frequently Asked Questions

What is the IUPAC name of N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The IUPAC name of N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide (CID 47083781) is N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide.
What is the SMILES notation for N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The canonical SMILES for N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is CCn1ccc2cc(NC(=O)C3CCCN(C(=O)c4cccs4)C3)ccc21.
What is the InChIKey of N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
The InChIKey is UIRPQINDSGYLNI-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H23N3O2S/c1-2-23-11-9-15-13-17(7-8-18(15)23)22-20(25)16-5-3-10-24(14-16)21(26)19-6-4-12-27-19/h4,6-9,11-13,16H,2-3,5,10,14H2,1H3,(H,22,25).
What are the key properties of N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide?
N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide has a molecular weight of 381.50 g/mol, XLogP of 4.21, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(1-ethylindol-5-yl)-1-(thiophene-2-carbonyl)piperidine-3-carboxamide is sourced from PubChem (CID 47083781), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).