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

C10H16N2O2 — CID 107225975

IUPAC(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
SMILESCc1ocnc1CN1CCC[C@H](O)C1
InChIInChI=1S/C10H16N2O2/c1-8-10(11-7-14-8)6-12-4-2-3-9(13)5-12/h7,9,13H,2-6H2,1H3/t9-/m0/s1
InChIKeyUFPYFPIXWJBRHF-VIFPVBQESA-N
MW196.25 g/mol
LogP0.94
Rot. Bonds2

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

(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol (PubChem CID 107225975) has the molecular formula C10H16N2O2 and a molecular weight of 196.25 g/mol. Its IUPAC name is (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol.

Molecular Properties

Compound Name(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
PubChem CID107225975
Molecular FormulaC10H16N2O2
Molecular Weight196.25 g/mol
Exact Mass196.12
IUPAC Name(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
SMILESCc1ocnc1CN1CCC[C@H](O)C1
InChIInChI=1S/C10H16N2O2/c1-8-10(11-7-14-8)6-12-4-2-3-9(13)5-12/h7,9,13H,2-6H2,1H3/t9-/m0/s1
InChIKeyUFPYFPIXWJBRHF-VIFPVBQESA-N
XLogP0.94
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500196.25
LogP ≤ 50.94
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[4-[(5-methyl-1,3-oxazol-4-yl)methyl]morpholin-2-yl]methanol
CID 115772870
(3S)-1-[(4,5-dimethyl-1,3-oxazol-2-yl)methyl]piperidin-3-ol
CID 107226246
1-[(3-chloropyrazin-2-yl)methyl]piperidin-3-ol
CID 71649793
1-[(5-methyl-2-phenyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol
CID 110883667
1-[[2-(3,5-difluorophenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 56755911
4-methyl-1-[(5-methyl-1,3-oxazol-4-yl)methyl]pyrrolidin-3-amine
CID 103577352
1-[(5-methylfuran-2-yl)methyl]piperidin-3-ol
CID 62022683
1-[(3-methylphenyl)methyl]piperidin-3-ol
CID 23792038
(3R)-1-[[5-methyl-2-(4-methylsulfanylphenyl)-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 95468992
(3S)-1-[[2-(4-methoxy-2,5-dimethylphenyl)-5-methyl-1,3-oxazol-4-yl]methyl]piperidin-3-ol
CID 95210795
1-[(2-methyl-1,3-thiazol-4-yl)methyl]piperidin-3-ol
CID 60645207
(3S)-1-[(4-ethylphenyl)methyl]piperidin-3-ol
CID 27055523

Frequently Asked Questions

What is the IUPAC name of (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The IUPAC name of (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol (CID 107225975) is (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol.
What is the SMILES notation for (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The canonical SMILES for (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol is Cc1ocnc1CN1CCC[C@H](O)C1.
What is the InChIKey of (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
The InChIKey is UFPYFPIXWJBRHF-VIFPVBQESA-N. The full InChI is InChI=1S/C10H16N2O2/c1-8-10(11-7-14-8)6-12-4-2-3-9(13)5-12/h7,9,13H,2-6H2,1H3/t9-/m0/s1.
What are the key properties of (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol?
(3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol has a molecular weight of 196.25 g/mol, XLogP of 0.94, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3S)-1-[(5-methyl-1,3-oxazol-4-yl)methyl]piperidin-3-ol is sourced from PubChem (CID 107225975), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).