cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone

C15H22N2OS — CID 53016850

IUPACcyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
SMILESCC(C)c1csc(C2CCCN(C(=O)C3CC3)C2)n1
InChIInChI=1S/C15H22N2OS/c1-10(2)13-9-19-14(16-13)12-4-3-7-17(8-12)15(18)11-5-6-11/h9-12H,3-8H2,1-2H3
InChIKeyJAAPAASIJWVLSN-UHFFFAOYSA-N
MW278.42 g/mol
LogP3.38
Rot. Bonds3

About cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone

cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone (PubChem CID 53016850) has the molecular formula C15H22N2OS and a molecular weight of 278.42 g/mol. Its IUPAC name is cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
PubChem CID53016850
Molecular FormulaC15H22N2OS
Molecular Weight278.42 g/mol
Exact Mass278.15
IUPAC Namecyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
SMILESCC(C)c1csc(C2CCCN(C(=O)C3CC3)C2)n1
InChIInChI=1S/C15H22N2OS/c1-10(2)13-9-19-14(16-13)12-4-3-7-17(8-12)15(18)11-5-6-11/h9-12H,3-8H2,1-2H3
InChIKeyJAAPAASIJWVLSN-UHFFFAOYSA-N
XLogP3.38
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500278.42
LogP ≤ 53.38
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-[2-(dimethylamino)ethyl]-N-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 24817856
2-Methyl-1-[1-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-3-azabicyclo[3.1.0]hexan-3-yl]propan-1-one
CID 129091785
N,N-diethyl-2-(2-propan-2-yl-1,3-thiazol-4-yl)acetamide
CID 45819395
N,N-diethyl-1-[2-(2-ethyl-1,3-thiazol-4-yl)acetyl]piperidine-4-carboxamide
CID 51099994
2-(2-Ethyl-1,3-thiazol-4-yl)-1-[4-(piperidine-1-carbonyl)piperidin-1-yl]ethanone
CID 53513549
1-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 53525495
2-(2-tert-butyl-1,3-thiazol-4-yl)-N-(1-methylpiperidin-4-yl)acetamide
CID 53557253
2-(2-tert-butyl-1,3-thiazol-4-yl)-N-(1-ethylpiperidin-4-yl)acetamide
CID 53592083
2-(2-Ethyl-1,3-thiazol-4-yl)-1-[4-(pyrrolidine-1-carbonyl)piperidin-1-yl]ethanone
CID 56819149
1-[2-(4-Tert-butyl-1,3-thiazol-2-yl)piperidin-1-yl]-2-[cyclopropyl(methyl)amino]ethanone
CID 72122321
2-[Cyclopropyl(methyl)amino]-1-[2-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]ethanone
CID 72122386
2-Ethyl-6-[3-(4-ethyl-1,3-thiazol-2-yl)piperidine-1-carbonyl]-4,5-dihydropyridazin-3-one
CID 72135953

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone (CID 53016850) is cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone is CC(C)c1csc(C2CCCN(C(=O)C3CC3)C2)n1.
What is the InChIKey of cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The InChIKey is JAAPAASIJWVLSN-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H22N2OS/c1-10(2)13-9-19-14(16-13)12-4-3-7-17(8-12)15(18)11-5-6-11/h9-12H,3-8H2,1-2H3.
What are the key properties of cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone has a molecular weight of 278.42 g/mol, XLogP of 3.38, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-(4-propan-2-yl-1,3-thiazol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 53016850), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).