2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol

C11H24N2O2 — CID 123382529

IUPAC2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol
SMILESCC(N)(CO)CC(O)CN1CCCCC1
InChIInChI=1S/C11H24N2O2/c1-11(12,9-14)7-10(15)8-13-5-3-2-4-6-13/h10,14-15H,2-9,12H2,1H3
InChIKeyHSIAKIHIFOMFAS-UHFFFAOYSA-N
MW216.32 g/mol
LogP-0.07
Rot. Bonds5

About 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol

2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol (PubChem CID 123382529) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol.

Molecular Properties

Compound Name2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol
PubChem CID123382529
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC Name2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol
SMILESCC(N)(CO)CC(O)CN1CCCCC1
InChIInChI=1S/C11H24N2O2/c1-11(12,9-14)7-10(15)8-13-5-3-2-4-6-13/h10,14-15H,2-9,12H2,1H3
InChIKeyHSIAKIHIFOMFAS-UHFFFAOYSA-N
XLogP-0.07
TPSA69.72 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 5-0.07
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

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Related Compounds

1-[1-(2-Hydroxypropyl)-2-methylpiperazin-2-yl]propan-2-ol
CID 22593184
4-Amino-1-[(4-amino-2-hydroxy-4-methylpentyl)-(2-hydroxyethyl)amino]-4-methylpentan-2-ol
CID 58308932
4-Amino-1-[bis(2-hydroxyethyl)amino]-4-methylpentan-2-ol
CID 58308939
4-Amino-1-[2-hydroxyethyl(methyl)amino]-4-methylpentan-2-ol
CID 58308951
1-[3-(Hydroxymethyl)piperidin-1-yl]propan-2-ol
CID 60886566
(3-Amino-1-methylpiperidin-3-yl)methanol
CID 81713584
2-Amino-5-(dimethylamino)-2-methylpentane-1,4-diol
CID 88103370
2-Amino-2-methylpropan-1-ol;2,5-bis(dimethylamino)-2-methylpentane-1,4-diol
CID 88305482
2,5-Bis(hydroxymethylamino)-2-methylpentane-1,4-diol
CID 88432944
2-Amino-5-(ethylamino)-2-methylpentane-1,4-diol
CID 90990354
2-(Dimethylamino)-1-piperidin-3-ylethanol
CID 115006908
1-(4-Amino-1-methylpiperidin-4-yl)propan-2-ol
CID 115014078

Frequently Asked Questions

What is the IUPAC name of 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol?
The IUPAC name of 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol (CID 123382529) is 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol.
What is the SMILES notation for 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol?
The canonical SMILES for 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol is CC(N)(CO)CC(O)CN1CCCCC1.
What is the InChIKey of 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol?
The InChIKey is HSIAKIHIFOMFAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-11(12,9-14)7-10(15)8-13-5-3-2-4-6-13/h10,14-15H,2-9,12H2,1H3.
What are the key properties of 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol?
2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol has a molecular weight of 216.32 g/mol, XLogP of -0.07, 5 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-2-methyl-5-piperidin-1-ylpentane-1,4-diol is sourced from PubChem (CID 123382529), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).