1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol

C12H25NO2 — CID 62272555

IUPAC1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol
SMILESCCCC(C)(CO)CN1CCC(O)CC1
InChIInChI=1S/C12H25NO2/c1-3-6-12(2,10-14)9-13-7-4-11(15)5-8-13/h11,14-15H,3-10H2,1-2H3
InChIKeyNXINTNKWIDQHKN-UHFFFAOYSA-N
MW215.34 g/mol
LogP1.24
Rot. Bonds5

About 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol

1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol (PubChem CID 62272555) has the molecular formula C12H25NO2 and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol.

Molecular Properties

Compound Name1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol
PubChem CID62272555
Molecular FormulaC12H25NO2
Molecular Weight215.34 g/mol
Exact Mass215.19
IUPAC Name1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol
SMILESCCCC(C)(CO)CN1CCC(O)CC1
InChIInChI=1S/C12H25NO2/c1-3-6-12(2,10-14)9-13-7-4-11(15)5-8-13/h11,14-15H,3-10H2,1-2H3
InChIKeyNXINTNKWIDQHKN-UHFFFAOYSA-N
XLogP1.24
TPSA43.70 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 51.24
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

2-[(4-cyclopropylpiperazin-1-yl)methyl]-2-methylpentan-1-ol
CID 62266189
2-methyl-2-[(4-propylpiperazin-1-yl)methyl]pentan-1-ol
CID 62270175
1-[2-(aminomethyl)-2-methylpentyl]pyrrolidin-3-ol
CID 62941187
2-methyl-2-[[4-(2-methylpropyl)piperazin-1-yl]methyl]pentan-1-ol
CID 62777293
2-[(4-hydroxypiperidin-1-yl)methyl]-2-methylpentanal
CID 62277702
1-(2-hydroxy-2-methylpropyl)piperidin-4-ol
CID 60886320
1-[2-methyl-2-(propylaminomethyl)pentyl]pyrrolidin-3-ol
CID 55131551
2-[[3-(methoxymethyl)piperidin-1-yl]methyl]-2-methylpentan-1-ol
CID 106589129
2-[(2-ethylazepan-1-yl)methyl]-2-methylpentan-1-ol
CID 113441966
1-(3-bromo-2,2-dimethylpropyl)piperidin-4-ol
CID 65000596
2-[[4-(2-chlorophenyl)piperazin-1-yl]methyl]-2-methylpentan-1-ol
CID 62271457
2-[[2-[(dimethylamino)methyl]pyrrolidin-1-yl]methyl]-2-methylpentan-1-ol
CID 62890251

Frequently Asked Questions

What is the IUPAC name of 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol?
The IUPAC name of 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol (CID 62272555) is 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol.
What is the SMILES notation for 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol?
The canonical SMILES for 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol is CCCC(C)(CO)CN1CCC(O)CC1.
What is the InChIKey of 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol?
The InChIKey is NXINTNKWIDQHKN-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H25NO2/c1-3-6-12(2,10-14)9-13-7-4-11(15)5-8-13/h11,14-15H,3-10H2,1-2H3.
What are the key properties of 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol?
1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol has a molecular weight of 215.34 g/mol, XLogP of 1.24, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[2-(hydroxymethyl)-2-methylpentyl]piperidin-4-ol is sourced from PubChem (CID 62272555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).