N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide

C19H23N3O2S — CID 60529728

IUPACN-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide
SMILESCCC(=O)N1CCCC(C(=O)N(c2ccccc2)c2nc(C)cs2)C1
InChIInChI=1S/C19H23N3O2S/c1-3-17(23)21-11-7-8-15(12-21)18(24)22(16-9-5-4-6-10-16)19-20-14(2)13-25-19/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3
InChIKeyZIYLOKUKESNZOD-UHFFFAOYSA-N
MW357.48 g/mol
LogP3.76
Rot. Bonds4

About N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide

N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide (PubChem CID 60529728) has the molecular formula C19H23N3O2S and a molecular weight of 357.48 g/mol. Its IUPAC name is N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide.

Molecular Properties

Compound NameN-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide
PubChem CID60529728
Molecular FormulaC19H23N3O2S
Molecular Weight357.48 g/mol
Exact Mass357.15
IUPAC NameN-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide
SMILESCCC(=O)N1CCCC(C(=O)N(c2ccccc2)c2nc(C)cs2)C1
InChIInChI=1S/C19H23N3O2S/c1-3-17(23)21-11-7-8-15(12-21)18(24)22(16-9-5-4-6-10-16)19-20-14(2)13-25-19/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3
InChIKeyZIYLOKUKESNZOD-UHFFFAOYSA-N
XLogP3.76
TPSA53.51 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500357.48
LogP ≤ 53.76
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-phenyl-1-propanoyl-N-propan-2-ylpiperidine-3-carboxamide
CID 87037742
1-(benzenesulfonyl)-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpiperidine-4-carboxamide
CID 26176459
1-benzylsulfonyl-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpiperidine-4-carboxamide
CID 38906012
N-(4-methyl-1,3-thiazol-2-yl)-5-oxo-N-phenyl-1-(pyridin-2-ylmethyl)pyrrolidine-3-carboxamide
CID 60529709
N-(1,3-benzothiazol-2-yl)-N-(4-ethylphenyl)-1-(pyrrolidine-1-carbonyl)piperidine-3-carboxamide
CID 112830366
(2S)-N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-2,3-dihydro-1-benzofuran-2-carboxamide
CID 25492097
N-(4-methyl-1,3-thiazol-2-yl)-N-phenylhexanamide
CID 78778253
3-[4-(azepan-1-ylsulfonyl)phenyl]-N-(4-methyl-1,3-thiazol-2-yl)-N-phenylpropanamide
CID 26176493
N-benzyl-1-propanoylpiperidine-3-carboxamide
CID 47255092
1-[(3R)-3-[(2R)-2-benzylpiperidine-1-carbonyl]piperidin-1-yl]propan-1-one
CID 95297085
N-(2-benzamidoethyl)-1-propanoylpiperidine-3-carboxamide
CID 47049072
1-[ethyl(phenyl)carbamoyl]piperidine-3-carboxylic acid
CID 43318507

Frequently Asked Questions

What is the IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide?
The IUPAC name of N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide (CID 60529728) is N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide.
What is the SMILES notation for N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide?
The canonical SMILES for N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide is CCC(=O)N1CCCC(C(=O)N(c2ccccc2)c2nc(C)cs2)C1.
What is the InChIKey of N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide?
The InChIKey is ZIYLOKUKESNZOD-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H23N3O2S/c1-3-17(23)21-11-7-8-15(12-21)18(24)22(16-9-5-4-6-10-16)19-20-14(2)13-25-19/h4-6,9-10,13,15H,3,7-8,11-12H2,1-2H3.
What are the key properties of N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide?
N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide has a molecular weight of 357.48 g/mol, XLogP of 3.76, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methyl-1,3-thiazol-2-yl)-N-phenyl-1-propanoylpiperidine-3-carboxamide is sourced from PubChem (CID 60529728), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).