2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole

C9H12N2O — CID 19018542

IUPAC2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole
SMILESCc1ncc(C2=CCCNC2)o1
InChIInChI=1S/C9H12N2O/c1-7-11-6-9(12-7)8-3-2-4-10-5-8/h3,6,10H,2,4-5H2,1H3
InChIKeyMSUKOGYIDCEXMZ-UHFFFAOYSA-N
MW164.21 g/mol
LogP1.36
Rot. Bonds1

About 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole

2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole (PubChem CID 19018542) has the molecular formula C9H12N2O and a molecular weight of 164.21 g/mol. Its IUPAC name is 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole.

Molecular Properties

Compound Name2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole
PubChem CID19018542
Molecular FormulaC9H12N2O
Molecular Weight164.21 g/mol
Exact Mass164.09
IUPAC Name2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole
SMILESCc1ncc(C2=CCCNC2)o1
InChIInChI=1S/C9H12N2O/c1-7-11-6-9(12-7)8-3-2-4-10-5-8/h3,6,10H,2,4-5H2,1H3
InChIKeyMSUKOGYIDCEXMZ-UHFFFAOYSA-N
XLogP1.36
TPSA38.06 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500164.21
LogP ≤ 51.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-methyl-5-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-oxazole
CID 19018532
5-Methyl-2-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole
CID 19018537
2-[2-(4-Fluorocyclohexa-1,3-dien-1-yl)-1,3-oxazol-5-yl]ethanamine
CID 123211598
5-(2-tert-butyl-1,3-oxazol-5-yl)-3-fluoro-1H-pyridin-2-one
CID 167910904
5-(1-methyl-3,6-dihydro-2H-pyridin-5-yl)-1,3-oxazole
CID 18960884
5-Methyl-2-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole;hydrochloride
CID 19018536
2-Methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole;oxalic acid
CID 19018541
ethenyl 5-(2-methyl-1,3-oxazol-5-yl)-3,6-dihydro-2H-pyridine-1-carboxylate
CID 19018581
2-[[5-(2-methyl-1,3-oxazol-5-yl)-3,6-dihydro-2H-pyridin-1-yl]oxy]-2-oxoacetic acid
CID 57314716
5-Cyclopenta-1,4-dien-1-yl-2-methyl-1,3-oxazole
CID 58646236
5-(2-Methyl-1,3-oxazol-5-yl)-6-oxo-1,6-dihydropyridine-2-carboxylic acid
CID 68380198
5-(5-Ethyl-1,3-oxazol-2-yl)-6-methyl-2-oxo-1,2-dihydropyridine-3-carbonitrile
CID 68913978

Frequently Asked Questions

What is the IUPAC name of 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole?
The IUPAC name of 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole (CID 19018542) is 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole.
What is the SMILES notation for 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole?
The canonical SMILES for 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole is Cc1ncc(C2=CCCNC2)o1.
What is the InChIKey of 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole?
The InChIKey is MSUKOGYIDCEXMZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H12N2O/c1-7-11-6-9(12-7)8-3-2-4-10-5-8/h3,6,10H,2,4-5H2,1H3.
What are the key properties of 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole?
2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole has a molecular weight of 164.21 g/mol, XLogP of 1.36, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-methyl-5-(1,2,3,6-tetrahydropyridin-5-yl)-1,3-oxazole is sourced from PubChem (CID 19018542), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).