1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol

C16H20N2O2 — CID 110883667

IUPAC1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
SMILESCc1oc(-c2ccccc2)nc1CN1CCCC(O)C1
InChIInChI=1S/C16H20N2O2/c1-12-15(11-18-9-5-8-14(19)10-18)17-16(20-12)13-6-3-2-4-7-13/h2-4,6-7,14,19H,5,8-11H2,1H3
InChIKeyCUECNIDRYHIEAK-UHFFFAOYSA-N
MW272.35 g/mol
LogP2.61
Rot. Bonds3

About 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol

1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol (PubChem CID 110883667) has the molecular formula C16H20N2O2 and a molecular weight of 272.35 g/mol. Its IUPAC name is 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
PubChem CID110883667
Molecular FormulaC16H20N2O2
Molecular Weight272.35 g/mol
Exact Mass272.15
IUPAC Name1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
SMILESCc1oc(-c2ccccc2)nc1CN1CCCC(O)C1
InChIInChI=1S/C16H20N2O2/c1-12-15(11-18-9-5-8-14(19)10-18)17-16(20-12)13-6-3-2-4-7-13/h2-4,6-7,14,19H,5,8-11H2,1H3
InChIKeyCUECNIDRYHIEAK-UHFFFAOYSA-N
XLogP2.61
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500272.35
LogP ≤ 52.61
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(3R)-1-[[5-methyl-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 95468992
1-[[2-(3,5-difluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 56755911
5-[(3S)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-yl]-1,3,4-oxadiazol-2-amine
CID 164641050
(3S)-1-[[2-(4-methoxy-2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 95210795
1-[[2-(2,5-dimethoxyphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 56869440
(3S)-1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]-3-(trifluoromethyl)piperidin-3-ol
CID 95348668
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
2-(3,5-difluorophenyl)-5-methyl-4-[(3-phenylmethoxypiperidin-1-yl)methyl]-1,3-oxazole
CID 45212654
(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
CID 107225975
ethyl (3R)-1-[[5-methyl-2-(3-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidine-3-carboxylate
CID 150258829
[1-[[5-methyl-2-(4-methylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-3-yl]-morpholin-4-ylmethanone
CID 24791417

Frequently Asked Questions

What is the IUPAC name of 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The IUPAC name of 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol (CID 110883667) is 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol.
What is the SMILES notation for 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The canonical SMILES for 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol is Cc1oc(-c2ccccc2)nc1CN1CCCC(O)C1.
What is the InChIKey of 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The InChIKey is CUECNIDRYHIEAK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H20N2O2/c1-12-15(11-18-9-5-8-14(19)10-18)17-16(20-12)13-6-3-2-4-7-13/h2-4,6-7,14,19H,5,8-11H2,1H3.
What are the key properties of 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol has a molecular weight of 272.35 g/mol, XLogP of 2.61, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol is sourced from PubChem (CID 110883667), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).