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

C20H23N3O2 — CID 26399402

IUPAC2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole
SMILESCc1oc(-c2ccoc2)nc1CN1CCN(c2ccccc2)C[C@H]1C
InChIInChI=1S/C20H23N3O2/c1-15-12-23(18-6-4-3-5-7-18)10-9-22(15)13-19-16(2)25-20(21-19)17-8-11-24-14-17/h3-8,11,14-15H,9-10,12-13H2,1-2H3/t15-/m1/s1
InChIKeyINNUPVHTQLDAKS-OAHLLOKOSA-N
MW337.42 g/mol
LogP3.95
Rot. Bonds4

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

2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole (PubChem CID 26399402) has the molecular formula C20H23N3O2 and a molecular weight of 337.42 g/mol. Its IUPAC name is 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole.

Molecular Properties

Compound Name2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole
PubChem CID26399402
Molecular FormulaC20H23N3O2
Molecular Weight337.42 g/mol
Exact Mass337.18
IUPAC Name2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole
SMILESCc1oc(-c2ccoc2)nc1CN1CCN(c2ccccc2)C[C@H]1C
InChIInChI=1S/C20H23N3O2/c1-15-12-23(18-6-4-3-5-7-18)10-9-22(15)13-19-16(2)25-20(21-19)17-8-11-24-14-17/h3-8,11,14-15H,9-10,12-13H2,1-2H3/t15-/m1/s1
InChIKeyINNUPVHTQLDAKS-OAHLLOKOSA-N
XLogP3.95
TPSA45.65 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500337.42
LogP ≤ 53.95
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Analyze 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole with MolForge

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Related Compounds

2-(4-chlorophenyl)-5-methyl-4-[(2-methyl-4-phenylpiperazin-1-yl)methyl]-1,3-oxazole
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2-methyl-1-[(5-methyl-1H-1,2,4-triazol-3-yl)methyl]-4-phenylpiperazine
CID 131939868
2-(furan-3-yl)-5-methyl-4-[[2-(2-pyrazol-1-ylethyl)piperidin-1-yl]methyl]-1,3-oxazole
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N-methyl-4-[5-methyl-4-[(4-phenylpiperazin-1-yl)methyl]-1,3-oxazol-2-yl]benzamide
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(2S,6R)-2,6-dimethyl-4-[1-[[5-methyl-2-(4-phenylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-4-yl]morpholine
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1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
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(2R)-2-methyl-4-phenyl-1-[(1-propylimidazol-2-yl)methyl]piperazine
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3-benzhydryl-5-[[2-methyl-4-(4-methylphenyl)piperazin-1-yl]methyl]-1,2,4-oxadiazole
CID 45178559
5-methyl-4-[[(2S)-2-methylpiperazin-1-yl]methyl]-2-(4-methylsulfanylphenyl)-1,3-oxazole
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Frequently Asked Questions

What is the IUPAC name of 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole?
The IUPAC name of 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole (CID 26399402) is 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole.
What is the SMILES notation for 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole?
The canonical SMILES for 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole is Cc1oc(-c2ccoc2)nc1CN1CCN(c2ccccc2)C[C@H]1C.
What is the InChIKey of 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole?
The InChIKey is INNUPVHTQLDAKS-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H23N3O2/c1-15-12-23(18-6-4-3-5-7-18)10-9-22(15)13-19-16(2)25-20(21-19)17-8-11-24-14-17/h3-8,11,14-15H,9-10,12-13H2,1-2H3/t15-/m1/s1.
What are the key properties of 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole?
2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole has a molecular weight of 337.42 g/mol, XLogP of 3.95, 4 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(furan-3-yl)-5-methyl-4-[[(2R)-2-methyl-4-phenylpiperazin-1-yl]methyl]-1,3-oxazole is sourced from PubChem (CID 26399402), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).