1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone

C12H18N2O2 — CID 71160307

IUPAC1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)c2ccno2)CC1
InChIInChI=1S/C12H18N2O2/c1-2-3-10-5-8-14(9-6-10)12(15)11-4-7-13-16-11/h4,7,10H,2-3,5-6,8-9H2,1H3
InChIKeyVKEVKKQDANGAHF-UHFFFAOYSA-N
MW222.29 g/mol
LogP2.33
Rot. Bonds3

About 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone

1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone (PubChem CID 71160307) has the molecular formula C12H18N2O2 and a molecular weight of 222.29 g/mol. Its IUPAC name is 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone.

Molecular Properties

Compound Name1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone
PubChem CID71160307
Molecular FormulaC12H18N2O2
Molecular Weight222.29 g/mol
Exact Mass222.14
IUPAC Name1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone
SMILESCCCC1CCN(C(=O)c2ccno2)CC1
InChIInChI=1S/C12H18N2O2/c1-2-3-10-5-8-14(9-6-10)12(15)11-4-7-13-16-11/h4,7,10H,2-3,5-6,8-9H2,1H3
InChIKeyVKEVKKQDANGAHF-UHFFFAOYSA-N
XLogP2.33
TPSA46.34 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500222.29
LogP ≤ 52.33
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Analyze 1,2-oxazol-5-yl-(4-propylpiperidin-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

N-[1-[[(2S,3S)-1-amino-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 137633152
3,7-Diazabicyclo[3.3.1]nonan-3-yl(1,2-oxazol-5-yl)methanone
CID 24945458
N-[(2S)-1-[[(2S,3S)-1-[(2S)-2-(tert-butylcarbamoyl)piperidin-1-yl]-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 56640398
5-Isoxazoyl-Cha-Ile-NH2
CID 49788154
Tert-butyl 4-[(1,2-oxazole-5-carbonylamino)methyl]piperidine-1-carboxylate
CID 2738834
4,4-Dimethyl-3-[1-(1,2-oxazole-5-carbonyl)piperidin-4-yl]-1,3-oxazolidin-2-one
CID 23736486
N-butyl-2-methyl-1-(1,2-oxazole-5-carbonyl)piperidine-2-carboxamide
CID 46942971
N-[(2S)-1-[[(2S,3S)-1-[[3-[4-(aminomethyl)piperidin-1-yl]-3-oxopropyl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 49788234
N-[(2S)-1-[[(2S,3S)-1-[[5-[4-(aminomethyl)piperidin-1-yl]-5-oxopentyl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-cyclohexyl-1-oxopropan-2-yl]-1,2-oxazole-5-carboxamide
CID 49788235
N-ethyl-1-(1,2-oxazol-5-ylmethyl)-N-(2,2,2-trifluoroethyl)piperidine-3-carboxamide
CID 71986627
[(5aR,9aS)-4-(oxan-4-yl)-2,3,5,5a,6,7,9,9a-octahydropyrido[4,3-f][1,4]oxazepin-8-yl]-(1,2-oxazol-5-yl)methanone
CID 97403392
1-[(2S,3aR,7aS)-2-[(dimethylamino)methyl]-5-(1,2-oxazole-5-carbonyl)-3,3a,4,6,7,7a-hexahydro-2H-pyrrolo[3,2-c]pyridin-1-yl]ethanone
CID 97408157

Frequently Asked Questions

What is the IUPAC name of 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone?
The IUPAC name of 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone (CID 71160307) is 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone.
What is the SMILES notation for 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone?
The canonical SMILES for 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone is CCCC1CCN(C(=O)c2ccno2)CC1.
What is the InChIKey of 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone?
The InChIKey is VKEVKKQDANGAHF-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H18N2O2/c1-2-3-10-5-8-14(9-6-10)12(15)11-4-7-13-16-11/h4,7,10H,2-3,5-6,8-9H2,1H3.
What are the key properties of 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone?
1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone has a molecular weight of 222.29 g/mol, XLogP of 2.33, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-oxazol-5-yl-(4-propylpiperidin-1-yl)methanone is sourced from PubChem (CID 71160307), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).