[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone

C18H28N4O2 — CID 95188466

IUPAC[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone
SMILESCC(C)C1=NO[C@@H](C(=O)N2CCC(c3cc(C(C)C)n[nH]3)CC2)C1
InChIInChI=1S/C18H28N4O2/c1-11(2)14-9-16(20-19-14)13-5-7-22(8-6-13)18(23)17-10-15(12(3)4)21-24-17/h9,11-13,17H,5-8,10H2,1-4H3,(H,19,20)/t17-/m1/s1
InChIKeyVLZUCXYQDBUOBC-QGZVFWFLSA-N
MW332.45 g/mol
LogP3.04
Rot. Bonds4

About [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone

[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone (PubChem CID 95188466) has the molecular formula C18H28N4O2 and a molecular weight of 332.45 g/mol. Its IUPAC name is [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone.

Molecular Properties

Compound Name[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone
PubChem CID95188466
Molecular FormulaC18H28N4O2
Molecular Weight332.45 g/mol
Exact Mass332.22
IUPAC Name[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone
SMILESCC(C)C1=NO[C@@H](C(=O)N2CCC(c3cc(C(C)C)n[nH]3)CC2)C1
InChIInChI=1S/C18H28N4O2/c1-11(2)14-9-16(20-19-14)13-5-7-22(8-6-13)18(23)17-10-15(12(3)4)21-24-17/h9,11-13,17H,5-8,10H2,1-4H3,(H,19,20)/t17-/m1/s1
InChIKeyVLZUCXYQDBUOBC-QGZVFWFLSA-N
XLogP3.04
TPSA70.58 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500332.45
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-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

[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]-(4-propan-2-yl-1,3-thiazol-2-yl)methanone
CID 56717963
1-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]-3-(4,5,6,7-tetrahydro-1H-indazol-3-yl)propan-1-one
CID 56714261
1,5-dimethyl-4-[[4-(3-propan-2-yl-4,5-dihydro-1,2-oxazole-5-carbonyl)-1,4-diazepan-1-yl]methyl]pyrrole-2-carbonitrile
CID 139599699
(5-methylspiro[6,7-dihydro-1H-imidazo[4,5-c]pyridine-4,4'-piperidine]-1'-yl)-(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methanone
CID 72861999
(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)-[4-(thiophene-3-carbonyl)-1,4-diazepan-1-yl]methanone
CID 135118695
[4-(5-benzyl-1H-pyrazol-3-yl)piperidin-1-yl]-[(5S)-3-methyl-4,5-dihydro-1,2-oxazol-5-yl]methanone
CID 95228912
tert-butyl 4-[3-[1-(2-chloropropanoyl)piperidin-4-yl]-1H-pyrazol-5-yl]piperidine-1-carboxylate
CID 146098685
6-methyl-2-[[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]pyridin-3-ol
CID 56711478
5-(1-propan-2-ylpiperidin-4-yl)-1H-pyrazole-3-carboxylic acid
CID 115092280
4-azatricyclo[4.3.1.13,8]undecan-4-yl-(3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl)methanone
CID 131898316
[3-(3-propan-2-yl-1H-pyrazol-5-yl)cyclopentyl] formate
CID 177323847
3-[[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methyl]chromen-4-one
CID 56715093

Frequently Asked Questions

What is the IUPAC name of [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone?
The IUPAC name of [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone (CID 95188466) is [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone.
What is the SMILES notation for [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone?
The canonical SMILES for [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone is CC(C)C1=NO[C@@H](C(=O)N2CCC(c3cc(C(C)C)n[nH]3)CC2)C1.
What is the InChIKey of [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone?
The InChIKey is VLZUCXYQDBUOBC-QGZVFWFLSA-N. The full InChI is InChI=1S/C18H28N4O2/c1-11(2)14-9-16(20-19-14)13-5-7-22(8-6-13)18(23)17-10-15(12(3)4)21-24-17/h9,11-13,17H,5-8,10H2,1-4H3,(H,19,20)/t17-/m1/s1.
What are the key properties of [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone?
[(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone has a molecular weight of 332.45 g/mol, XLogP of 3.04, 4 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [(5R)-3-propan-2-yl-4,5-dihydro-1,2-oxazol-5-yl]-[4-(3-propan-2-yl-1H-pyrazol-5-yl)piperidin-1-yl]methanone is sourced from PubChem (CID 95188466), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).