3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol

C15H26N2O2 — CID 55076462

IUPAC3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol
SMILESCC(C)(C)c1cnc(CN2CCCC2CCCO)o1
InChIInChI=1S/C15H26N2O2/c1-15(2,3)13-10-16-14(19-13)11-17-8-4-6-12(17)7-5-9-18/h10,12,18H,4-9,11H2,1-3H3
InChIKeyNXRGLHKXGUHPRY-UHFFFAOYSA-N
MW266.38 g/mol
LogP2.71
Rot. Bonds5

About 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol

3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol (PubChem CID 55076462) has the molecular formula C15H26N2O2 and a molecular weight of 266.38 g/mol. Its IUPAC name is 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol.

Molecular Properties

Compound Name3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol
PubChem CID55076462
Molecular FormulaC15H26N2O2
Molecular Weight266.38 g/mol
Exact Mass266.20
IUPAC Name3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol
SMILESCC(C)(C)c1cnc(CN2CCCC2CCCO)o1
InChIInChI=1S/C15H26N2O2/c1-15(2,3)13-10-16-14(19-13)11-17-8-4-6-12(17)7-5-9-18/h10,12,18H,4-9,11H2,1-3H3
InChIKeyNXRGLHKXGUHPRY-UHFFFAOYSA-N
XLogP2.71
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.38
LogP ≤ 52.71
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol with MolForge

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Related Compounds

(1-((5-(Tert-butyl)oxazol-2-yl)methyl)piperidin-4-yl)methanol
CID 52274438
(S)-(1-((5-(tert-Butyl)oxazol-2-yl)methyl)pyrrolidin-2-yl)methanol
CID 53574116
5-Tert-butyl-2-[(2-ethylpiperidin-1-yl)methyl]-1,3-oxazole
CID 56684365
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-[1-[(1-hydroxycyclohexyl)methyl]pyrrolidin-3-yl]acetamide
CID 71927170
N-[(5-ethyl-1,3-oxazol-2-yl)methyl]-N-methyl-1-(oxan-4-ylmethyl)pyrrolidin-3-amine
CID 71928387
methyl (2S,4R)-1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-4-hydroxypyrrolidine-2-carboxylate
CID 56785931
3-[1-(5-Tert-butyl-1,3-oxazol-2-yl)ethyl-methylamino]-1,1,1-trifluoropropan-2-ol
CID 109968028
3-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl-(2,2,2-trifluoroethyl)amino]propan-1-ol
CID 111022252
1-[1-[1-(5-Tert-butyl-1,3-oxazol-2-yl)ethyl]piperidin-4-yl]-2,2,2-trifluoroethanol
CID 112327044
[(2S,4S)-1-[(5-cyclopropyl-1,3-oxazol-2-yl)methyl]-4-fluoropyrrolidin-2-yl]methanol
CID 128986817
[(2S,4S)-1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]-4-fluoropyrrolidin-2-yl]methanol
CID 132370311
2-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl-(2,2-dimethylpropyl)amino]ethanol
CID 53621551

Frequently Asked Questions

What is the IUPAC name of 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol?
The IUPAC name of 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol (CID 55076462) is 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol.
What is the SMILES notation for 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol?
The canonical SMILES for 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol is CC(C)(C)c1cnc(CN2CCCC2CCCO)o1.
What is the InChIKey of 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol?
The InChIKey is NXRGLHKXGUHPRY-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H26N2O2/c1-15(2,3)13-10-16-14(19-13)11-17-8-4-6-12(17)7-5-9-18/h10,12,18H,4-9,11H2,1-3H3.
What are the key properties of 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol?
3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol has a molecular weight of 266.38 g/mol, XLogP of 2.71, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]pyrrolidin-2-yl]propan-1-ol is sourced from PubChem (CID 55076462), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).