5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole

C10H16N2O — CID 84657560

IUPAC5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
SMILESCc1cnc(CC2CCCCN2)o1
InChIInChI=1S/C10H16N2O/c1-8-7-12-10(13-8)6-9-4-2-3-5-11-9/h7,9,11H,2-6H2,1H3
InChIKeyXKFJYQWCJMDAFK-UHFFFAOYSA-N
MW180.25 g/mol
LogP1.67
Rot. Bonds2

About 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole

5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole (PubChem CID 84657560) has the molecular formula C10H16N2O and a molecular weight of 180.25 g/mol. Its IUPAC name is 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole.

Molecular Properties

Compound Name5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
PubChem CID84657560
Molecular FormulaC10H16N2O
Molecular Weight180.25 g/mol
Exact Mass180.13
IUPAC Name5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
SMILESCc1cnc(CC2CCCCN2)o1
InChIInChI=1S/C10H16N2O/c1-8-7-12-10(13-8)6-9-4-2-3-5-11-9/h7,9,11H,2-6H2,1H3
InChIKeyXKFJYQWCJMDAFK-UHFFFAOYSA-N
XLogP1.67
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500180.25
LogP ≤ 51.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-(2-fluoropropan-2-yl)-2-(pyrrolidin-2-ylmethyl)-1,3-oxazole
CID 84782347
5-(1,1-difluoroethyl)-2-(pyrrolidin-2-ylmethyl)-1,3-oxazole
CID 84784625
2-(cyclobutylmethyl)-5-methyl-1,3-oxazole
CID 119055129
4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 105462178
2-chloro-5-(piperidin-2-ylmethyl)-1,3,4-oxadiazole
CID 84670367
6-methyl-2-(piperidin-2-ylmethyl)-1,3-benzoxazole
CID 83859316
2-(1-methylcyclobutyl)-5-(piperidin-2-ylmethyl)-1,3,4-oxadiazole
CID 115040962
3-methyl-2-(piperidin-2-ylmethyl)pyridine
CID 4715233
2-[5-methyl-2-[[(2S)-piperidin-2-yl]methyl]-1,3-oxazol-4-yl]propan-2-ol
CID 125493206
3-methyl-5-(piperidin-2-ylmethyl)-1,2-oxazole
CID 83846520
4,5-dimethyl-N-(piperidin-2-ylmethyl)pyrimidin-2-amine
CID 83838031
5-methoxy-2-(piperidin-2-ylmethyl)pyrimidine
CID 117231656

Frequently Asked Questions

What is the IUPAC name of 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The IUPAC name of 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole (CID 84657560) is 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole.
What is the SMILES notation for 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The canonical SMILES for 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole is Cc1cnc(CC2CCCCN2)o1.
What is the InChIKey of 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The InChIKey is XKFJYQWCJMDAFK-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N2O/c1-8-7-12-10(13-8)6-9-4-2-3-5-11-9/h7,9,11H,2-6H2,1H3.
What are the key properties of 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole has a molecular weight of 180.25 g/mol, XLogP of 1.67, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole is sourced from PubChem (CID 84657560), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).