N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide

C15H17N3OS — CID 62046501

IUPACN-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1cscn1
InChIInChI=1S/C15H17N3OS/c19-15(13-10-20-11-16-13)17-12-6-2-3-7-14(12)18-8-4-1-5-9-18/h2-3,6-7,10-11H,1,4-5,8-9H2,(H,17,19)
InChIKeyXPNBGSHOJNOMGT-UHFFFAOYSA-N
MW287.39 g/mol
LogP3.39
Rot. Bonds3

About N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide

N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide (PubChem CID 62046501) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide.

Molecular Properties

Compound NameN-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide
PubChem CID62046501
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC NameN-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide
SMILESO=C(Nc1ccccc1N1CCCCC1)c1cscn1
InChIInChI=1S/C15H17N3OS/c19-15(13-10-20-11-16-13)17-12-6-2-3-7-14(12)18-8-4-1-5-9-18/h2-3,6-7,10-11H,1,4-5,8-9H2,(H,17,19)
InChIKeyXPNBGSHOJNOMGT-UHFFFAOYSA-N
XLogP3.39
TPSA45.23 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 53.39
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[2-(4-hydroxypiperidin-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 110932033
N-(2-chlorophenyl)-1,3-thiazole-4-carboxamide
CID 62046847
5-[(2-pyrrolidin-1-ylphenyl)carbamoyl]pyrazine-2-carboxylic acid
CID 120684789
N-[2-(azepan-1-yl)phenyl]benzamide
CID 24652732
2-(2-aminoethyl)-N-[2-(azepan-1-yl)phenyl]-1,3-thiazole-4-carboxamide
CID 120641148
N-[2-(azepan-1-yl)phenyl]-5,6-dichloropyridine-3-carboxamide
CID 18287671
N-[2-(azepan-1-yl)phenyl]-2-methyl-1,3-thiazole-5-carboxamide
CID 71881060
5-acetyl-N-(2-piperidin-1-ylphenyl)thiophene-2-carboxamide
CID 11255926
4-amino-N-(2-piperidin-1-ylphenyl)benzamide
CID 119828017
N-(2-ethylphenyl)-1,3-thiazole-4-carboxamide
CID 62046507
2-iodo-N-(2-piperidin-1-ylphenyl)benzamide
CID 1308785
3,4-dichloro-N-(2-pyrrolidin-1-ylphenyl)benzamide
CID 960458

Frequently Asked Questions

What is the IUPAC name of N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide?
The IUPAC name of N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide (CID 62046501) is N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide.
What is the SMILES notation for N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide?
The canonical SMILES for N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide is O=C(Nc1ccccc1N1CCCCC1)c1cscn1.
What is the InChIKey of N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide?
The InChIKey is XPNBGSHOJNOMGT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c19-15(13-10-20-11-16-13)17-12-6-2-3-7-14(12)18-8-4-1-5-9-18/h2-3,6-7,10-11H,1,4-5,8-9H2,(H,17,19).
What are the key properties of N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide?
N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 3.39, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-piperidin-1-ylphenyl)-1,3-thiazole-4-carboxamide is sourced from PubChem (CID 62046501), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).