5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide

C18H20N2O2S — CID 2970344

IUPAC5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)cs1
InChIInChI=1S/C18H20N2O2S/c1-13-11-15(12-23-13)17(21)19-16-7-5-14(6-8-16)18(22)20-9-3-2-4-10-20/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21)
InChIKeyKYFIJYQZQGXIBD-UHFFFAOYSA-N
MW328.44 g/mol
LogP3.93
Rot. Bonds3

About 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide

5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide (PubChem CID 2970344) has the molecular formula C18H20N2O2S and a molecular weight of 328.44 g/mol. Its IUPAC name is 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide.

Molecular Properties

Compound Name5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide
PubChem CID2970344
Molecular FormulaC18H20N2O2S
Molecular Weight328.44 g/mol
Exact Mass328.12
IUPAC Name5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide
SMILESCc1cc(C(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)cs1
InChIInChI=1S/C18H20N2O2S/c1-13-11-15(12-23-13)17(21)19-16-7-5-14(6-8-16)18(22)20-9-3-2-4-10-20/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21)
InChIKeyKYFIJYQZQGXIBD-UHFFFAOYSA-N
XLogP3.93
TPSA49.41 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500328.44
LogP ≤ 53.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[4-(azepane-1-carbonyl)phenyl]-3-methylbenzamide
CID 17198989
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
3-iodo-4-methyl-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 26167470
N-[4-(piperidine-1-carbonyl)phenyl]thiophene-2-carboxamide
CID 761867
2-methyl-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 17123959
N-phenyl-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044285
3,5-dichloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 26167664
3-chloro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 2970403
3-amino-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 6939897
3-fluoro-N-[4-(piperidine-1-carbonyl)phenyl]benzamide
CID 2971545
N-(4-tert-butylphenyl)-4-(pyrrolidine-1-carbonyl)benzamide
CID 109044308

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide?
The IUPAC name of 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide (CID 2970344) is 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide.
What is the SMILES notation for 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide?
The canonical SMILES for 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide is Cc1cc(C(=O)Nc2ccc(C(=O)N3CCCCC3)cc2)cs1.
What is the InChIKey of 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide?
The InChIKey is KYFIJYQZQGXIBD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H20N2O2S/c1-13-11-15(12-23-13)17(21)19-16-7-5-14(6-8-16)18(22)20-9-3-2-4-10-20/h5-8,11-12H,2-4,9-10H2,1H3,(H,19,21).
What are the key properties of 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide?
5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide has a molecular weight of 328.44 g/mol, XLogP of 3.93, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-[4-(piperidine-1-carbonyl)phenyl]thiophene-3-carboxamide is sourced from PubChem (CID 2970344), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).