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

C12H19N3OS — CID 54958477

IUPACN-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCC(C)c1csc(NC(=O)C2CCNCC2)n1
InChIInChI=1S/C12H19N3OS/c1-8(2)10-7-17-12(14-10)15-11(16)9-3-5-13-6-4-9/h7-9,13H,3-6H2,1-2H3,(H,14,15,16)
InChIKeyIFHBPVXLYQYQCP-UHFFFAOYSA-N
MW253.37 g/mol
LogP2.20
Rot. Bonds3

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

N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide (PubChem CID 54958477) has the molecular formula C12H19N3OS and a molecular weight of 253.37 g/mol. Its IUPAC name is N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide.

Molecular Properties

Compound NameN-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
PubChem CID54958477
Molecular FormulaC12H19N3OS
Molecular Weight253.37 g/mol
Exact Mass253.12
IUPAC NameN-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
SMILESCC(C)c1csc(NC(=O)C2CCNCC2)n1
InChIInChI=1S/C12H19N3OS/c1-8(2)10-7-17-12(14-10)15-11(16)9-3-5-13-6-4-9/h7-9,13H,3-6H2,1-2H3,(H,14,15,16)
InChIKeyIFHBPVXLYQYQCP-UHFFFAOYSA-N
XLogP2.20
TPSA54.02 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500253.37
LogP ≤ 52.20
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

(2S)-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyrrolidine-2-carboxamide
CID 61482477
1-acetyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)azetidine-3-carboxamide
CID 73439343
1-acetyl-N-(4-propan-2-yl-1,3-thiazol-2-yl)pyrrolidine-3-carboxamide
CID 110246586
N-[4-(4-methylphenyl)-1,3-thiazol-2-yl]piperidine-4-carboxamide
CID 87405721
2-[(4-propan-2-yl-1,3-thiazol-2-yl)carbamoyl]cyclohexane-1-carboxylic acid
CID 61479820
N-(4-propan-2-yl-1,3-thiazol-2-yl)-1,3-thiazolidine-4-carboxamide
CID 61482668
N-(4-propan-2-yl-1,3-thiazol-2-yl)-4-propylpiperidine-4-carboxamide
CID 63129103
N-[(4-propan-2-yl-1,3-thiazol-2-yl)methyl]pyrrolidine-3-carboxamide;dihydrochloride
CID 119897431
N-(4-propan-2-yl-1,3-thiazol-2-yl)-2-pyrrolidin-2-ylacetamide
CID 54958427
1-(furan-2-carbonyl)-N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide
CID 37019192
methyl N-(4-propan-2-yl-1,3-thiazol-2-yl)carbamate
CID 58913263
N-[4-(1-aminoethyl)-1,3-thiazol-2-yl]-4-tert-butylcyclohexane-1-carboxamide
CID 64556065

Frequently Asked Questions

What is the IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The IUPAC name of N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide (CID 54958477) is N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide.
What is the SMILES notation for N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The canonical SMILES for N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide is CC(C)c1csc(NC(=O)C2CCNCC2)n1.
What is the InChIKey of N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
The InChIKey is IFHBPVXLYQYQCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H19N3OS/c1-8(2)10-7-17-12(14-10)15-11(16)9-3-5-13-6-4-9/h7-9,13H,3-6H2,1-2H3,(H,14,15,16).
What are the key properties of N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide?
N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide has a molecular weight of 253.37 g/mol, XLogP of 2.20, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-propan-2-yl-1,3-thiazol-2-yl)piperidine-4-carboxamide is sourced from PubChem (CID 54958477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).