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

C12H20N2O — CID 105462178

IUPAC4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
SMILESCCc1nc(CC2CCCCN2)oc1C
InChIInChI=1S/C12H20N2O/c1-3-11-9(2)15-12(14-11)8-10-6-4-5-7-13-10/h10,13H,3-8H2,1-2H3
InChIKeyJVDRPNFFZQRRNM-UHFFFAOYSA-N
MW208.30 g/mol
LogP2.23
Rot. Bonds3

About 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole

4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole (PubChem CID 105462178) has the molecular formula C12H20N2O and a molecular weight of 208.30 g/mol. Its IUPAC name is 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole.

Molecular Properties

Compound Name4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
PubChem CID105462178
Molecular FormulaC12H20N2O
Molecular Weight208.30 g/mol
Exact Mass208.16
IUPAC Name4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
SMILESCCc1nc(CC2CCCCN2)oc1C
InChIInChI=1S/C12H20N2O/c1-3-11-9(2)15-12(14-11)8-10-6-4-5-7-13-10/h10,13H,3-8H2,1-2H3
InChIKeyJVDRPNFFZQRRNM-UHFFFAOYSA-N
XLogP2.23
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500208.30
LogP ≤ 52.23
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-[5-methyl-2-[[(2S)-piperidin-2-yl]methyl]-1,3-oxazol-4-yl]propan-2-ol
CID 125493206
5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole
CID 84657560
4-ethyl-5-methyl-6-(piperidin-2-ylmethyl)pyrimidine
CID 83849476
6-methyl-2-(piperidin-2-ylmethyl)-1,3-benzoxazole
CID 83859316
5-methyl-2-propan-2-yl-4-(pyrrolidin-2-ylmethyl)-1,3-oxazole
CID 105462154
4-methyl-5-propan-2-yl-2-(pyrrolidin-2-ylmethyl)-1,3-oxazole
CID 105462186
2-chloro-5-(piperidin-2-ylmethyl)-1,3,4-oxadiazole
CID 84670367
4-ethyl-5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-thiazole
CID 62542496
5-methyl-2-(pyrrolidin-2-ylmethyl)-1,3-benzoxazole
CID 61372317
N-ethyl-N-methyl-5-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazol-3-amine
CID 116808442
2-(1-methylcyclobutyl)-5-(piperidin-2-ylmethyl)-1,3,4-oxadiazole
CID 115040962
3-propyl-5-(pyrrolidin-2-ylmethyl)-1,2,4-oxadiazole
CID 61371732

Frequently Asked Questions

What is the IUPAC name of 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The IUPAC name of 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole (CID 105462178) is 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole.
What is the SMILES notation for 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The canonical SMILES for 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole is CCc1nc(CC2CCCCN2)oc1C.
What is the InChIKey of 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
The InChIKey is JVDRPNFFZQRRNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H20N2O/c1-3-11-9(2)15-12(14-11)8-10-6-4-5-7-13-10/h10,13H,3-8H2,1-2H3.
What are the key properties of 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole?
4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole has a molecular weight of 208.30 g/mol, XLogP of 2.23, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethyl-5-methyl-2-(piperidin-2-ylmethyl)-1,3-oxazole is sourced from PubChem (CID 105462178), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).