N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide

C15H17N3OS — CID 91647273

IUPACN-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide
SMILESO=C(Nc1cnc(-c2ccccc2)s1)C1CCNCC1
InChIInChI=1S/C15H17N3OS/c19-14(11-6-8-16-9-7-11)18-13-10-17-15(20-13)12-4-2-1-3-5-12/h1-5,10-11,16H,6-9H2,(H,18,19)
InChIKeyMJUZDDMOTZAANR-UHFFFAOYSA-N
MW287.39 g/mol
LogP2.75
Rot. Bonds3

About N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide

N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide (PubChem CID 91647273) has the molecular formula C15H17N3OS and a molecular weight of 287.39 g/mol. Its IUPAC name is N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide
PubChem CID91647273
Molecular FormulaC15H17N3OS
Molecular Weight287.39 g/mol
Exact Mass287.11
IUPAC NameN-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide
SMILESO=C(Nc1cnc(-c2ccccc2)s1)C1CCNCC1
InChIInChI=1S/C15H17N3OS/c19-14(11-6-8-16-9-7-11)18-13-10-17-15(20-13)12-4-2-1-3-5-12/h1-5,10-11,16H,6-9H2,(H,18,19)
InChIKeyMJUZDDMOTZAANR-UHFFFAOYSA-N
XLogP2.75
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.39
LogP ≤ 52.75
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide?
The IUPAC name of N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide (CID 91647273) is N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide is O=C(Nc1cnc(-c2ccccc2)s1)C1CCNCC1.
What is the InChIKey of N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide?
The InChIKey is MJUZDDMOTZAANR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3OS/c19-14(11-6-8-16-9-7-11)18-13-10-17-15(20-13)12-4-2-1-3-5-12/h1-5,10-11,16H,6-9H2,(H,18,19).
What are the key properties of N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide?
N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide has a molecular weight of 287.39 g/mol, XLogP of 2.75, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-phenyl-1,3-thiazol-5-yl)piperidine-4-carboxamide is sourced from PubChem (CID 91647273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).