2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

C18H27N5O2 — CID 86773616

IUPAC2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCCn1cc(C2CCN(CC(=O)Nc3cc(C(C)C)no3)CC2)cn1
InChIInChI=1S/C18H27N5O2/c1-4-23-11-15(10-19-23)14-5-7-22(8-6-14)12-17(24)20-18-9-16(13(2)3)21-25-18/h9-11,13-14H,4-8,12H2,1-3H3,(H,20,24)
InChIKeyZVGHROZSPVIVJU-UHFFFAOYSA-N
MW345.45 g/mol
LogP2.83
Rot. Bonds6

About 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide

2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (PubChem CID 86773616) has the molecular formula C18H27N5O2 and a molecular weight of 345.45 g/mol. Its IUPAC name is 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.

Molecular Properties

Compound Name2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
PubChem CID86773616
Molecular FormulaC18H27N5O2
Molecular Weight345.45 g/mol
Exact Mass345.22
IUPAC Name2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
SMILESCCn1cc(C2CCN(CC(=O)Nc3cc(C(C)C)no3)CC2)cn1
InChIInChI=1S/C18H27N5O2/c1-4-23-11-15(10-19-23)14-5-7-22(8-6-14)12-17(24)20-18-9-16(13(2)3)21-25-18/h9-11,13-14H,4-8,12H2,1-3H3,(H,20,24)
InChIKeyZVGHROZSPVIVJU-UHFFFAOYSA-N
XLogP2.83
TPSA76.19 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500345.45
LogP ≤ 52.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide 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

2-(4-methylpiperidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 17395553
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(1H-pyrazol-5-yl)piperidin-1-yl]acetamide
CID 51104392
2-[4-(2-hydroxyethyl)piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 60689757
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[(2R)-2-(1,2,4-triazol-1-ylmethyl)morpholin-4-yl]acetamide
CID 95349962
2-(3-hydroxy-3-methylpyrrolidin-1-yl)-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 103728328
2-[(2R)-2-(4-fluorophenyl)morpholin-4-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 36874378
2-[3-(5-methyl-1H-pyrazol-3-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 71926982
2-[2-(hydroxymethyl)pyrrolidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 62015902
2-[4-[(3-propan-2-yl-1,2,4-oxadiazol-5-yl)methyl]piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 30891247
N-(3-propan-2-yl-1,2-oxazol-5-yl)-2-[4-(thiophen-2-ylmethyl)piperazin-1-yl]acetamide
CID 24626986
2-[(3S)-3-ethyl-4-[(2S)-2-hydroxypropyl]piperazin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide
CID 98767284
2-[4-(1-aminoethyl)piperidin-1-yl]-N-(3-methyl-1,2-oxazol-5-yl)acetamide
CID 63595182

Frequently Asked Questions

What is the IUPAC name of 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The IUPAC name of 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide (CID 86773616) is 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide.
What is the SMILES notation for 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The canonical SMILES for 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is CCn1cc(C2CCN(CC(=O)Nc3cc(C(C)C)no3)CC2)cn1.
What is the InChIKey of 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
The InChIKey is ZVGHROZSPVIVJU-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H27N5O2/c1-4-23-11-15(10-19-23)14-5-7-22(8-6-14)12-17(24)20-18-9-16(13(2)3)21-25-18/h9-11,13-14H,4-8,12H2,1-3H3,(H,20,24).
What are the key properties of 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide?
2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide has a molecular weight of 345.45 g/mol, XLogP of 2.83, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[4-(1-ethylpyrazol-4-yl)piperidin-1-yl]-N-(3-propan-2-yl-1,2-oxazol-5-yl)acetamide is sourced from PubChem (CID 86773616), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).