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

C13H18N2OS — CID 53016832

IUPACcyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
SMILESCc1csc(C2CCCN(C(=O)C3CC3)C2)n1
InChIInChI=1S/C13H18N2OS/c1-9-8-17-12(14-9)11-3-2-6-15(7-11)13(16)10-4-5-10/h8,10-11H,2-7H2,1H3
InChIKeyRFNVVGPWILSMJY-UHFFFAOYSA-N
MW250.37 g/mol
LogP2.57
Rot. Bonds2

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

cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone (PubChem CID 53016832) has the molecular formula C13H18N2OS and a molecular weight of 250.37 g/mol. Its IUPAC name is cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
PubChem CID53016832
Molecular FormulaC13H18N2OS
Molecular Weight250.37 g/mol
Exact Mass250.11
IUPAC Namecyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone
SMILESCc1csc(C2CCCN(C(=O)C3CC3)C2)n1
InChIInChI=1S/C13H18N2OS/c1-9-8-17-12(14-9)11-3-2-6-15(7-11)13(16)10-4-5-10/h8,10-11H,2-7H2,1H3
InChIKeyRFNVVGPWILSMJY-UHFFFAOYSA-N
XLogP2.57
TPSA33.20 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500250.37
LogP ≤ 52.57
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[2-(dimethylamino)ethyl]-N-methyl-N-[(4-methyl-1,3-thiazol-2-yl)methyl]-6-oxopiperidine-3-carboxamide
CID 24817856
2,2-Dimethyl-1-[1-[2-(2-methyl-1,3-thiazol-4-yl)ethynyl]-3-azabicyclo[3.1.0]hexan-3-yl]propan-1-one
CID 129091768
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
1-[1-[2-(2-Methyl-1,3-thiazol-4-yl)ethynyl]-3-azabicyclo[3.1.0]hexan-3-yl]pentan-1-one
CID 129091788
1-[2-(dimethylamino)ethyl]-N-methyl-N-[(2-methyl-1,3-thiazol-4-yl)methyl]-6-oxo-3-piperidinecarboxamide
CID 45171544
1-N-[2-(4-methyl-1,3-thiazol-2-yl)ethyl]piperidine-1,4-dicarboxamide
CID 45810788
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-propylpiperidine-4-carboxamide
CID 53519126
1-[(2-tert-butyl-1,3-thiazol-4-yl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 53521435
1-[(2-ethyl-1,3-thiazol-4-yl)methyl]-N,N-dimethylpiperidine-4-carboxamide
CID 53525495

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone (CID 53016832) is cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone is Cc1csc(C2CCCN(C(=O)C3CC3)C2)n1.
What is the InChIKey of cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
The InChIKey is RFNVVGPWILSMJY-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H18N2OS/c1-9-8-17-12(14-9)11-3-2-6-15(7-11)13(16)10-4-5-10/h8,10-11H,2-7H2,1H3.
What are the key properties of cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone?
cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone has a molecular weight of 250.37 g/mol, XLogP of 2.57, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[3-(4-methyl-1,3-thiazol-2-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 53016832), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).