N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine

C15H19N3O — CID 54902966

IUPACN-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine
SMILESCc1nc(-c2ccc(NC3CCNCC3)cc2)co1
InChIInChI=1S/C15H19N3O/c1-11-17-15(10-19-11)12-2-4-13(5-3-12)18-14-6-8-16-9-7-14/h2-5,10,14,16,18H,6-9H2,1H3
InChIKeyZEWUPXVOBVZDFD-UHFFFAOYSA-N
MW257.34 g/mol
LogP2.81
Rot. Bonds3

About N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine

N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine (PubChem CID 54902966) has the molecular formula C15H19N3O and a molecular weight of 257.34 g/mol. Its IUPAC name is N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine.

Molecular Properties

Compound NameN-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine
PubChem CID54902966
Molecular FormulaC15H19N3O
Molecular Weight257.34 g/mol
Exact Mass257.15
IUPAC NameN-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine
SMILESCc1nc(-c2ccc(NC3CCNCC3)cc2)co1
InChIInChI=1S/C15H19N3O/c1-11-17-15(10-19-11)12-2-4-13(5-3-12)18-14-6-8-16-9-7-14/h2-5,10,14,16,18H,6-9H2,1H3
InChIKeyZEWUPXVOBVZDFD-UHFFFAOYSA-N
XLogP2.81
TPSA50.09 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500257.34
LogP ≤ 52.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine?
The IUPAC name of N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine (CID 54902966) is N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine.
What is the SMILES notation for N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine?
The canonical SMILES for N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine is Cc1nc(-c2ccc(NC3CCNCC3)cc2)co1.
What is the InChIKey of N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine?
The InChIKey is ZEWUPXVOBVZDFD-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3O/c1-11-17-15(10-19-11)12-2-4-13(5-3-12)18-14-6-8-16-9-7-14/h2-5,10,14,16,18H,6-9H2,1H3.
What are the key properties of N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine?
N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine has a molecular weight of 257.34 g/mol, XLogP of 2.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-(2-methyl-1,3-oxazol-4-yl)phenyl]piperidin-4-amine is sourced from PubChem (CID 54902966), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).