[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol

C16H21N3O2 — CID 59674842

IUPAC[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol
SMILESCc1cc(N2CCN(Cc3ccccc3)C[C@@H]2CO)no1
InChIInChI=1S/C16H21N3O2/c1-13-9-16(17-21-13)19-8-7-18(11-15(19)12-20)10-14-5-3-2-4-6-14/h2-6,9,15,20H,7-8,10-12H2,1H3/t15-/m1/s1
InChIKeyXNSVZDCFYHDYAY-OAHLLOKOSA-N
MW287.36 g/mol
LogP1.67
Rot. Bonds4

About [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol

[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol (PubChem CID 59674842) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol.

Molecular Properties

Compound Name[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol
PubChem CID59674842
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol
SMILESCc1cc(N2CCN(Cc3ccccc3)C[C@@H]2CO)no1
InChIInChI=1S/C16H21N3O2/c1-13-9-16(17-21-13)19-8-7-18(11-15(19)12-20)10-14-5-3-2-4-6-14/h2-6,9,15,20H,7-8,10-12H2,1H3/t15-/m1/s1
InChIKeyXNSVZDCFYHDYAY-OAHLLOKOSA-N
XLogP1.67
TPSA52.74 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol 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

(1,4-dibenzylpiperazin-2-yl)methanol
CID 10827800
[(2S)-1-amino-4-benzylpiperazin-2-yl]methanol
CID 71157233
5-methyl-3-[(2R)-2-(phenylmethoxymethyl)piperazin-1-yl]-1,2-oxazole
CID 71121325
1-(4-benzylpiperazin-1-yl)-2-[(5-methyl-1,2-oxazol-3-yl)amino]ethanone
CID 109002094
N-[(1S,5R)-3-benzyl-3-azabicyclo[3.1.0]hexan-6-yl]-5-methyl-1,2-oxazole-3-carboxamide
CID 154780076
(2R)-1-[(2R)-1,4-dibenzylpiperazin-2-yl]propan-2-ol
CID 100942318
(E)-N-[(3R)-1-benzylpyrrolidin-3-yl]-3-[2,5-dimethyl-1-(5-methyl-1,2-oxazol-3-yl)pyrrol-3-yl]prop-2-enamide
CID 9488599
2-[4-(1-benzylpiperidine-3-carbonyl)piperazin-1-yl]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60579845
[(2R)-4-benzylmorpholin-2-yl]methanol;hydrochloride
CID 132648231
(1,4-dibenzyl-6-methylpiperazin-2-yl)methanol
CID 135137500
dideuterio-(1,4-dibenzylpiperazin-2-yl)methanol
CID 170598960
(2S)-2-[(2S)-4-benzyl-2-(hydroxymethyl)piperazin-1-yl]-2-chloroacetaldehyde
CID 135348226

Frequently Asked Questions

What is the IUPAC name of [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol?
The IUPAC name of [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol (CID 59674842) is [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol.
What is the SMILES notation for [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol?
The canonical SMILES for [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol is Cc1cc(N2CCN(Cc3ccccc3)C[C@@H]2CO)no1.
What is the InChIKey of [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol?
The InChIKey is XNSVZDCFYHDYAY-OAHLLOKOSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-13-9-16(17-21-13)19-8-7-18(11-15(19)12-20)10-14-5-3-2-4-6-14/h2-6,9,15,20H,7-8,10-12H2,1H3/t15-/m1/s1.
What are the key properties of [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol?
[(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol has a molecular weight of 287.36 g/mol, XLogP of 1.67, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for [(2R)-4-benzyl-1-(5-methyl-1,2-oxazol-3-yl)piperazin-2-yl]methanol is sourced from PubChem (CID 59674842), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).