cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone

C15H21N3O4 — CID 95803568

IUPACcyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone
SMILESCOc1cnc(C2(O)CCN(C(=O)C3CC3)CC2)c(OC)n1
InChIInChI=1S/C15H21N3O4/c1-21-11-9-16-12(13(17-11)22-2)15(20)5-7-18(8-6-15)14(19)10-3-4-10/h9-10,20H,3-8H2,1-2H3
InChIKeyUOFXIYYXBXBSIM-UHFFFAOYSA-N
MW307.35 g/mol
LogP0.71
Rot. Bonds4

About cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone

cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone (PubChem CID 95803568) has the molecular formula C15H21N3O4 and a molecular weight of 307.35 g/mol. Its IUPAC name is cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone.

Molecular Properties

Compound Namecyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone
PubChem CID95803568
Molecular FormulaC15H21N3O4
Molecular Weight307.35 g/mol
Exact Mass307.15
IUPAC Namecyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone
SMILESCOc1cnc(C2(O)CCN(C(=O)C3CC3)CC2)c(OC)n1
InChIInChI=1S/C15H21N3O4/c1-21-11-9-16-12(13(17-11)22-2)15(20)5-7-18(8-6-15)14(19)10-3-4-10/h9-10,20H,3-8H2,1-2H3
InChIKeyUOFXIYYXBXBSIM-UHFFFAOYSA-N
XLogP0.71
TPSA84.78 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500307.35
LogP ≤ 50.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-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

3-amino-1-(3,5-dimethoxypyrazin-2-yl)cyclopentan-1-ol
CID 113404073
[1-(5-bromo-4-methoxypyrimidin-2-yl)piperidin-4-yl]-(4,4-difluoropiperidin-1-yl)methanone
CID 155974138
cyclopropyl-(4-methoxy-4-methylpiperidin-1-yl)methanone;ethane
CID 164564342
N-[1-(cyclopropanecarbonyl)-4-(4-methoxyphenyl)piperidin-4-yl]acetamide
CID 1444021
(4,4-difluoropiperidin-1-yl)-[1-(6-methoxy-2-pyridinyl)piperidin-4-yl]methanone
CID 155975856
cyclopropyl-[4-(4-methoxyphenoxy)piperidin-1-yl]methanone
CID 110396800
cyclopropyl-[4-(6-methoxypyridazin-3-yl)piperazin-1-yl]methanone
CID 16883287
[4-hydroxy-4-(1H-pyrazol-5-yl)piperidin-1-yl]-(6-methoxy-1,2,3,4-tetrahydronaphthalen-2-yl)methanone
CID 167834752
7-(cyclopropanecarbonyl)-2-(4-methoxyphenyl)-2,7-diazaspiro[4.4]nonan-3-one
CID 131649039
N-(4-methoxyphenyl)-4-(pyrrolidine-1-carbonyl)cyclohexane-1-carboxamide
CID 109145697
cyclopropyl-[4-hydroxy-4-[2-[[2-(methoxymethyl)pyrrolidin-1-yl]methyl]-1,3-thiazol-4-yl]piperidin-1-yl]methanone
CID 162918157
1-[4-[4-(4-acetylpiperazine-1-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 2375184

Frequently Asked Questions

What is the IUPAC name of cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone?
The IUPAC name of cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone (CID 95803568) is cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone.
What is the SMILES notation for cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone?
The canonical SMILES for cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone is COc1cnc(C2(O)CCN(C(=O)C3CC3)CC2)c(OC)n1.
What is the InChIKey of cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone?
The InChIKey is UOFXIYYXBXBSIM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N3O4/c1-21-11-9-16-12(13(17-11)22-2)15(20)5-7-18(8-6-15)14(19)10-3-4-10/h9-10,20H,3-8H2,1-2H3.
What are the key properties of cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone?
cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone has a molecular weight of 307.35 g/mol, XLogP of 0.71, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for cyclopropyl-[4-(3,5-dimethoxypyrazin-2-yl)-4-hydroxypiperidin-1-yl]methanone is sourced from PubChem (CID 95803568), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).