[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol

C14H24N2O2 — CID 60968742

IUPAC[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol
SMILESCC(C)(C)c1cnc(CN2CCCCC2CO)o1
InChIInChI=1S/C14H24N2O2/c1-14(2,3)12-8-15-13(18-12)9-16-7-5-4-6-11(16)10-17/h8,11,17H,4-7,9-10H2,1-3H3
InChIKeyRCVSNZVJHGAKLR-UHFFFAOYSA-N
MW252.36 g/mol
LogP2.32
Rot. Bonds3

About [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol

[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol (PubChem CID 60968742) has the molecular formula C14H24N2O2 and a molecular weight of 252.36 g/mol. Its IUPAC name is [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol.

Molecular Properties

Compound Name[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol
PubChem CID60968742
Molecular FormulaC14H24N2O2
Molecular Weight252.36 g/mol
Exact Mass252.18
IUPAC Name[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol
SMILESCC(C)(C)c1cnc(CN2CCCCC2CO)o1
InChIInChI=1S/C14H24N2O2/c1-14(2,3)12-8-15-13(18-12)9-16-7-5-4-6-11(16)10-17/h8,11,17H,4-7,9-10H2,1-3H3
InChIKeyRCVSNZVJHGAKLR-UHFFFAOYSA-N
XLogP2.32
TPSA49.50 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500252.36
LogP ≤ 52.32
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-((5-(Tert-butyl)oxazol-2-yl)methyl)piperidin-4-yl)methanol
CID 52274438
4-[[1-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]methyl]morpholine
CID 53529388
(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-[[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]methyl]-N-ethylethanamine
CID 71895082
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
ethyl N-methyl-N-[1-[(5-propan-2-yl-1,3-oxazol-2-yl)methyl]piperidin-4-yl]carbamate
CID 75371375
1-(5-tert-butyl-1,3-oxazol-2-yl)-N-methyl-N-(oxan-3-ylmethyl)ethanamine
CID 75376264
4-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]morpholine-3-carboxamide
CID 75471043
2-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl-(2,2,2-trifluoroethyl)amino]ethanol
CID 103856849
1-[(5-Tert-butyl-1,3-oxazol-2-yl)methyl]-4-(trifluoromethyl)piperidin-4-ol
CID 109848535

Frequently Asked Questions

What is the IUPAC name of [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol?
The IUPAC name of [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol (CID 60968742) is [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol.
What is the SMILES notation for [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol?
The canonical SMILES for [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol is CC(C)(C)c1cnc(CN2CCCCC2CO)o1.
What is the InChIKey of [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol?
The InChIKey is RCVSNZVJHGAKLR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H24N2O2/c1-14(2,3)12-8-15-13(18-12)9-16-7-5-4-6-11(16)10-17/h8,11,17H,4-7,9-10H2,1-3H3.
What are the key properties of [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol?
[1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol has a molecular weight of 252.36 g/mol, XLogP of 2.32, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-[(5-tert-butyl-1,3-oxazol-2-yl)methyl]piperidin-2-yl]methanol is sourced from PubChem (CID 60968742), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).