5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole

C15H20N2O2 — CID 117098143

IUPAC5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole
SMILESCC(C)c1nc2cc(OC3CCNCC3)ccc2o1
InChIInChI=1S/C15H20N2O2/c1-10(2)15-17-13-9-12(3-4-14(13)19-15)18-11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3
InChIKeyGPVXLVVTBQDMOV-UHFFFAOYSA-N
MW260.34 g/mol
LogP3.08
Rot. Bonds3

About 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole

5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole (PubChem CID 117098143) has the molecular formula C15H20N2O2 and a molecular weight of 260.34 g/mol. Its IUPAC name is 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole.

Molecular Properties

Compound Name5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole
PubChem CID117098143
Molecular FormulaC15H20N2O2
Molecular Weight260.34 g/mol
Exact Mass260.15
IUPAC Name5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole
SMILESCC(C)c1nc2cc(OC3CCNCC3)ccc2o1
InChIInChI=1S/C15H20N2O2/c1-10(2)15-17-13-9-12(3-4-14(13)19-15)18-11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3
InChIKeyGPVXLVVTBQDMOV-UHFFFAOYSA-N
XLogP3.08
TPSA47.29 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.34
LogP ≤ 53.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

5-(piperidin-3-ylmethoxy)-2-propan-2-yl-1,3-benzoxazole
CID 117098151
2-propan-2-yl-N-pyrrolidin-3-yl-1,3-benzoxazol-5-amine
CID 79731105
N-cyclopropyl-2-propan-2-yl-1,3-benzoxazol-5-amine
CID 103439136
2-methyl-5-piperidin-3-yloxy-1,3-benzoxazole
CID 84695591
2-methyl-6-piperidin-4-yloxyquinoline
CID 123255075
N-(piperidin-2-ylmethyl)-2-propan-2-yl-1,3-benzoxazol-5-amine
CID 106633538
2-methyl-6-piperidin-4-yloxychromen-4-one
CID 28815119
2-propan-2-yl-6,7-dihydro-5H-pyrrolo[3,4-f][1,3]benzoxazole
CID 96619337
3-methyl-6-piperidin-4-yloxy-2H-indazole
CID 84694870
4-(4-propan-2-yloxyphenoxy)piperidine
CID 89453291
2-propan-2-yl-1,3-benzoxazole-5-thiol
CID 138604621
N-(3-methoxycyclohexyl)-2-propan-2-yl-1,3-benzoxazol-5-amine
CID 106871912

Frequently Asked Questions

What is the IUPAC name of 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole?
The IUPAC name of 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole (CID 117098143) is 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole.
What is the SMILES notation for 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole?
The canonical SMILES for 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole is CC(C)c1nc2cc(OC3CCNCC3)ccc2o1.
What is the InChIKey of 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole?
The InChIKey is GPVXLVVTBQDMOV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N2O2/c1-10(2)15-17-13-9-12(3-4-14(13)19-15)18-11-5-7-16-8-6-11/h3-4,9-11,16H,5-8H2,1-2H3.
What are the key properties of 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole?
5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole has a molecular weight of 260.34 g/mol, XLogP of 3.08, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-piperidin-4-yloxy-2-propan-2-yl-1,3-benzoxazole is sourced from PubChem (CID 117098143), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).