1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine

C15H19N3O — CID 117209870

IUPAC1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine
SMILESCc1ccccc1-c1oncc1N1CCC(N)CC1
InChIInChI=1S/C15H19N3O/c1-11-4-2-3-5-13(11)15-14(10-17-19-15)18-8-6-12(16)7-9-18/h2-5,10,12H,6-9,16H2,1H3
InChIKeyKAZKMRJIFQUGSI-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.58
Rot. Bonds2

About 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine

1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine (PubChem CID 117209870) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine.

Molecular Properties

Compound Name1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine
PubChem CID117209870
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC Name1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine
SMILESCc1ccccc1-c1oncc1N1CCC(N)CC1
InChIInChI=1S/C15H19N3O/c1-11-4-2-3-5-13(11)15-14(10-17-19-15)18-8-6-12(16)7-9-18/h2-5,10,12H,6-9,16H2,1H3
InChIKeyKAZKMRJIFQUGSI-UHFFFAOYSA-N
XLogP2.58
TPSA55.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.58
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-[5-(2-methylphenyl)pyrimidin-2-yl]piperidin-4-amine
CID 117224077
1-[1-(2-methylphenyl)pyrazol-4-yl]piperidin-4-amine
CID 117210939
1-(2,3-difluoro-4-methylphenyl)piperidin-4-amine
CID 107514198
2-[5-(4-aminopiperidin-1-yl)-2-methylpyrimidin-4-yl]phenol
CID 136934488
2-[5-(4-aminopiperidin-1-yl)-4-methylpyrimidin-2-yl]phenol
CID 136934608
1-(5-methyl-1-phenylpyrazol-4-yl)piperidin-4-amine
CID 117210577
1-[5-(2-methoxyphenyl)-1H-pyrazol-4-yl]piperidin-4-amine
CID 117209876
1-[5-cyclobutyl-1-(2-methylphenyl)pyrazol-4-yl]piperidin-4-amine
CID 117210828
1-[2-[3-(4-fluoro-3-methylphenyl)-1,2,4-oxadiazol-5-yl]phenyl]piperidin-4-amine
CID 166360940
2-(2-methylphenyl)-5,6,7,8-tetrahydro-[1,2,4]triazolo[1,5-a]pyridin-7-amine
CID 117128388
1-[5-[(3-chlorophenyl)methyl]-1,2-oxazol-4-yl]piperidin-4-amine
CID 117210033
[5-(2-methylphenyl)-1,2-oxazol-4-yl]-piperazin-1-ylmethanone
CID 95474291

Frequently Asked Questions

What is the IUPAC name of 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine?
The IUPAC name of 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine (CID 117209870) is 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine.
What is the SMILES notation for 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine?
The canonical SMILES for 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine is Cc1ccccc1-c1oncc1N1CCC(N)CC1.
What is the InChIKey of 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine?
The InChIKey is KAZKMRJIFQUGSI-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-4-2-3-5-13(11)15-14(10-17-19-15)18-8-6-12(16)7-9-18/h2-5,10,12H,6-9,16H2,1H3.
What are the key properties of 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine?
1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.58, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(2-methylphenyl)-1,2-oxazol-4-yl]piperidin-4-amine is sourced from PubChem (CID 117209870), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).