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

C17H18N2O2S — CID 761867

IUPACN-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1cccs1
InChIInChI=1S/C17H18N2O2S/c20-16(15-5-4-12-22-15)18-14-8-6-13(7-9-14)17(21)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,18,20)
InChIKeyMCAIPVUGMRIXBJ-UHFFFAOYSA-N
MW314.41 g/mol
LogP3.63
Rot. Bonds3

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

N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide (PubChem CID 761867) has the molecular formula C17H18N2O2S and a molecular weight of 314.41 g/mol. Its IUPAC name is N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide.

Molecular Properties

Compound NameN-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
PubChem CID761867
Molecular FormulaC17H18N2O2S
Molecular Weight314.41 g/mol
Exact Mass314.11
IUPAC NameN-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
SMILESO=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1cccs1
InChIInChI=1S/C17H18N2O2S/c20-16(15-5-4-12-22-15)18-14-8-6-13(7-9-14)17(21)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,18,20)
InChIKeyMCAIPVUGMRIXBJ-UHFFFAOYSA-N
XLogP3.63
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 ≤ 53.63
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(morpholine-4-carbonyl)phenyl]thiophene-2-carboxamide
CID 653867
N-[4-(piperidin-1-ylcarbamoyl)phenyl]thiophene-2-carboxamide
CID 9272074
N-[5-(azocane-1-carbonyl)-2-chlorophenyl]thiophene-2-carboxamide
CID 51145614
N-[4-[4-[2-(methylamino)-2-oxoethyl]piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide
CID 78801385
N-[4-(6,7-dihydro-4H-thieno[3,2-c]pyridine-5-carbonyl)phenyl]thiophene-2-carboxamide
CID 42470301
1-N,4-N-bis[4-(pyrrolidine-1-carbonyl)phenyl]benzene-1,4-dicarboxamide
CID 17196721
N-[4-(azepane-1-carbonyl)phenyl]benzamide
CID 17153241
N-[4-[4-(thiophen-3-ylmethyl)piperazine-1-carbonyl]phenyl]thiophene-2-carboxamide
CID 9181732
N-[4-[[3-chloro-5-(piperidine-1-carbonyl)-2-pyridinyl]oxy]phenyl]thiophene-2-carboxamide
CID 56584658
N-[4-[(thiophene-2-carbonylamino)carbamoyl]phenyl]thiophene-2-carboxamide
CID 1117998
N-[4-(5-bromo-4-methyl-3,6-dihydro-2H-pyridine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 100652972
(1-oxo-1-pyrrolidin-1-ylpropan-2-yl) 4-(thiophene-2-carbonylamino)benzoate
CID 18194139

Frequently Asked Questions

What is the IUPAC name of N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide?
The IUPAC name of N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide (CID 761867) is N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide.
What is the SMILES notation for N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide?
The canonical SMILES for N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide is O=C(Nc1ccc(C(=O)N2CCCCC2)cc1)c1cccs1.
What is the InChIKey of N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide?
The InChIKey is MCAIPVUGMRIXBJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O2S/c20-16(15-5-4-12-22-15)18-14-8-6-13(7-9-14)17(21)19-10-2-1-3-11-19/h4-9,12H,1-3,10-11H2,(H,18,20).
What are the key properties of N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide?
N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide has a molecular weight of 314.41 g/mol, XLogP of 3.63, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide is sourced from PubChem (CID 761867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).