2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole

C20H22N2O2 — CID 42401935

IUPAC2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole
SMILESCc1oc(-c2ccoc2)nc1CN1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H22N2O2/c1-15-19(21-20(24-15)18-9-12-23-14-18)13-22-10-7-17(8-11-22)16-5-3-2-4-6-16/h2-6,9,12,14,17H,7-8,10-11,13H2,1H3
InChIKeyAZAUNMWQKCUBPC-UHFFFAOYSA-N
MW322.41 g/mol
LogP4.62
Rot. Bonds4

About 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole

2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole (PubChem CID 42401935) has the molecular formula C20H22N2O2 and a molecular weight of 322.41 g/mol. Its IUPAC name is 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole
PubChem CID42401935
Molecular FormulaC20H22N2O2
Molecular Weight322.41 g/mol
Exact Mass322.17
IUPAC Name2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole
SMILESCc1oc(-c2ccoc2)nc1CN1CCC(c2ccccc2)CC1
InChIInChI=1S/C20H22N2O2/c1-15-19(21-20(24-15)18-9-12-23-14-18)13-22-10-7-17(8-11-22)16-5-3-2-4-6-16/h2-6,9,12,14,17H,7-8,10-11,13H2,1H3
InChIKeyAZAUNMWQKCUBPC-UHFFFAOYSA-N
XLogP4.62
TPSA42.41 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500322.41
LogP ≤ 54.62
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole 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-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole
CID 26399402
4-[[4-(4-fluorophenyl)piperidin-1-yl]methyl]-5-methyl-2-[4-(triazol-2-yl)phenyl]-1,3-oxazole
CID 172549653
5-methyl-2-(2-methylphenyl)-4-[(3-phenylpiperidin-1-yl)methyl]-1,3-oxazole
CID 45185948
(2S,6R)-2,6-dimethyl-4-[1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-4-yl]morpholine
CID 29124095
1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
CID 110883667
1-[1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-4-yl]-2-phenylethanol
CID 45195639
4-[[4-(1H-benzimidazol-2-yl)piperidin-1-yl]methyl]-2-(4-chlorophenyl)-5-methyl-1,3-oxazole
CID 42530326
5-methyl-4-[[4-(4-methylpiperazin-1-yl)sulfonylpiperazin-1-yl]methyl]-2-phenyl-1,3-oxazole
CID 52675581
2-(furan-3-yl)-5-methyl-4-[[2-(2-pyrazol-1-ylethyl)piperidin-1-yl]methyl]-1,3-oxazole
CID 45194451
2-phenyl-5-[(4-phenylpiperidin-1-yl)methyl]-1,3,4-oxadiazole
CID 46643022
1-[[2-(4-ethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidine-4-carboxylic acid
CID 6620480
1-[(5-methyl-2-thiophen-3-yl-1,3-oxazol-4-yl)methyl]piperidin-4-ol
CID 110923157

Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole?
The IUPAC name of 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole (CID 42401935) is 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole.
What is the SMILES notation for 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole?
The canonical SMILES for 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole is Cc1oc(-c2ccoc2)nc1CN1CCC(c2ccccc2)CC1.
What is the InChIKey of 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole?
The InChIKey is AZAUNMWQKCUBPC-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2O2/c1-15-19(21-20(24-15)18-9-12-23-14-18)13-22-10-7-17(8-11-22)16-5-3-2-4-6-16/h2-6,9,12,14,17H,7-8,10-11,13H2,1H3.
What are the key properties of 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole?
2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole has a molecular weight of 322.41 g/mol, XLogP of 4.62, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-5-methyl-4-[(4-phenylpiperidin-1-yl)methyl]-1,3-oxazole is sourced from PubChem (CID 42401935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).