5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide

C22H22N2OS — CID 126661345

IUPAC5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1csc(-c2ccccc2)c1
InChIInChI=1S/C22H22N2OS/c25-22(18-15-21(26-16-18)17-9-3-1-4-10-17)23-19-11-5-6-12-20(19)24-13-7-2-8-14-24/h1,3-6,9-12,15-16H,2,7-8,13-14H2,(H,23,25)
InChIKeyYUNLGOCSPKLSEF-UHFFFAOYSA-N
MW362.50 g/mol
LogP5.66
Rot. Bonds4

About 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide

5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide (PubChem CID 126661345) has the molecular formula C22H22N2OS and a molecular weight of 362.50 g/mol. Its IUPAC name is 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide.

Molecular Properties

Compound Name5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide
PubChem CID126661345
Molecular FormulaC22H22N2OS
Molecular Weight362.50 g/mol
Exact Mass362.15
IUPAC Name5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1csc(-c2ccccc2)c1
InChIInChI=1S/C22H22N2OS/c25-22(18-15-21(26-16-18)17-9-3-1-4-10-17)23-19-11-5-6-12-20(19)24-13-7-2-8-14-24/h1,3-6,9-12,15-16H,2,7-8,13-14H2,(H,23,25)
InChIKeyYUNLGOCSPKLSEF-UHFFFAOYSA-N
XLogP5.66
TPSA32.34 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500362.50
LogP ≤ 55.66
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-(azepan-1-yl)phenyl]benzamide
CID 24652732
5-nitro-N-(2-pyrrolidin-1-ylphenyl)thiophene-3-carboxamide
CID 46486849
3-iodo-N-(2-piperidin-1-ylphenyl)benzamide
CID 4501683
4-amino-N-(2-piperidin-1-ylphenyl)benzamide
CID 119828017
4-bromo-3,5-dihydroxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 3019649
3,5-dichloro-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 16557750
3,5-dimethyl-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 7492197
N-[2-(azepan-1-yl)phenyl]-4-ethylbenzamide
CID 18267161
N-(2-piperidin-1-ylphenyl)-3-(pyrrolidin-1-ylmethyl)benzamide
CID 60560100
3-propan-2-yloxy-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 960500
3,4-dichloro-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 960458
N-(2-piperidin-1-ylphenyl)-2,3-dihydro-1,4-benzodioxine-6-carboxamide
CID 2996637

Frequently Asked Questions

What is the IUPAC name of 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide?
The IUPAC name of 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide (CID 126661345) is 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide.
What is the SMILES notation for 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide?
The canonical SMILES for 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide is O=C(Nc1ccccc1N1CCCCC1)c1csc(-c2ccccc2)c1.
What is the InChIKey of 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide?
The InChIKey is YUNLGOCSPKLSEF-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H22N2OS/c25-22(18-15-21(26-16-18)17-9-3-1-4-10-17)23-19-11-5-6-12-20(19)24-13-7-2-8-14-24/h1,3-6,9-12,15-16H,2,7-8,13-14H2,(H,23,25).
What are the key properties of 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide?
5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide has a molecular weight of 362.50 g/mol, XLogP of 5.66, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-phenyl-N-(2-piperidin-1-ylphenyl)thiophene-3-carboxamide is sourced from PubChem (CID 126661345), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).