N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

C17H18N2O2S — CID 1075464

IUPACN-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C17H18N2O2S/c20-16(18-14-5-2-1-3-6-14)13-8-10-19(11-9-13)17(21)15-7-4-12-22-15/h1-7,12-13H,8-11H2,(H,18,20)
InChIKeyBVTWFNLJORBECD-UHFFFAOYSA-N
MW314.41 g/mol
LogP3.24
Rot. Bonds3

About N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide

N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (PubChem CID 1075464) has the molecular formula C17H18N2O2S and a molecular weight of 314.41 g/mol. Its IUPAC name is N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
PubChem CID1075464
Molecular FormulaC17H18N2O2S
Molecular Weight314.41 g/mol
Exact Mass314.11
IUPAC NameN-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
SMILESO=C(Nc1ccccc1)C1CCN(C(=O)c2cccs2)CC1
InChIInChI=1S/C17H18N2O2S/c20-16(18-14-5-2-1-3-6-14)13-8-10-19(11-9-13)17(21)15-7-4-12-22-15/h1-7,12-13H,8-11H2,(H,18,20)
InChIKeyBVTWFNLJORBECD-UHFFFAOYSA-N
XLogP3.24
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500314.41
LogP ≤ 53.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(thiophene-2-carbonyl)-N-[3-(thiophene-2-carbonylamino)phenyl]piperidine-4-carboxamide
CID 31520919
N-[4-(2-amino-2-oxoethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 31857710
N-[3,5-bis(trifluoromethyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 27844264
N-(9H-fluoren-2-yl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 46817722
1-(thiophene-2-carbonyl)piperidine-4-carboxylic acid
CID 760311
N-(6-phenoxy-3-pyridinyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 42101147
N-phenyl-4-(thiophene-2-carbonyl)piperazine-1-carboxamide
CID 51186037
N-(3-chloro-4-fluorophenyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 1075518
N-[4-(4-methylpiperidin-1-yl)sulfonylphenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 17224174
N-[4-(cyclohexylsulfamoyl)phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 17224205
N-[4-[3-(dimethylamino)pyrrolidin-1-yl]phenyl]-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 58866702
N-(1,1-diphenylethyl)-1-(thiophene-2-carbonyl)piperidine-4-carboxamide
CID 56522986

Frequently Asked Questions

What is the IUPAC name of N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The IUPAC name of N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide (CID 1075464) is N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide.
What is the SMILES notation for N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The canonical SMILES for N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is O=C(Nc1ccccc1)C1CCN(C(=O)c2cccs2)CC1.
What is the InChIKey of N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
The InChIKey is BVTWFNLJORBECD-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2S/c20-16(18-14-5-2-1-3-6-14)13-8-10-19(11-9-13)17(21)15-7-4-12-22-15/h1-7,12-13H,8-11H2,(H,18,20).
What are the key properties of N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide?
N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide has a molecular weight of 314.41 g/mol, XLogP of 3.24, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-phenyl-1-(thiophene-2-carbonyl)piperidine-4-carboxamide is sourced from PubChem (CID 1075464), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).