1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol

C16H32N2O2 — CID 60966443

IUPAC1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C16H32N2O2/c1-14(2)20-13-16(19)12-17-10-6-15(7-11-17)18-8-4-3-5-9-18/h14-16,19H,3-13H2,1-2H3
InChIKeyIANRVANVOOSTGF-UHFFFAOYSA-N
MW284.44 g/mol
LogP1.72
Rot. Bonds6

About 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol

1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol (PubChem CID 60966443) has the molecular formula C16H32N2O2 and a molecular weight of 284.44 g/mol. Its IUPAC name is 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol.

Molecular Properties

Compound Name1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
PubChem CID60966443
Molecular FormulaC16H32N2O2
Molecular Weight284.44 g/mol
Exact Mass284.25
IUPAC Name1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)CN1CCC(N2CCCCC2)CC1
InChIInChI=1S/C16H32N2O2/c1-14(2)20-13-16(19)12-17-10-6-15(7-11-17)18-8-4-3-5-9-18/h14-16,19H,3-13H2,1-2H3
InChIKeyIANRVANVOOSTGF-UHFFFAOYSA-N
XLogP1.72
TPSA35.94 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500284.44
LogP ≤ 51.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

1-[(2-methylpropan-2-yl)oxy]-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-ol
CID 110898534
(2S)-1-(4-piperidin-1-ylpiperidin-1-yl)propan-2-ol
CID 103934988
1-[4-[1-(methylamino)ethyl]piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 63987782
1-propan-2-yloxy-3-(4-propylazepan-1-yl)propan-2-ol
CID 62077210
1-[4-[(1-methylpiperidin-2-yl)methyl]piperazin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 111422240
1-[3-(azepan-1-ylmethyl)piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 110932791
1-(2-propan-2-ylphenoxy)-3-(4-pyrrolidin-1-ylpiperidin-1-yl)propan-2-ol
CID 110898544
1-[4-(1,1-dioxothiolan-3-yl)piperazin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 53369786
1-[4-[(tert-butylamino)methyl]piperidin-1-yl]-3-propan-2-yloxypropan-2-ol
CID 63987820
1-(2-hydroxy-3-propan-2-yloxypropyl)-4-methylpiperidin-4-ol
CID 115826056
(2S)-1-(4-cyclopropyl-1,4-diazepan-1-yl)-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 97210895
1-(2,2-dimethoxyethyl)-4-piperidin-1-ylpiperidine
CID 66223606

Frequently Asked Questions

What is the IUPAC name of 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol?
The IUPAC name of 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol (CID 60966443) is 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol.
What is the SMILES notation for 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol?
The canonical SMILES for 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol is CC(C)OCC(O)CN1CCC(N2CCCCC2)CC1.
What is the InChIKey of 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol?
The InChIKey is IANRVANVOOSTGF-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O2/c1-14(2)20-13-16(19)12-17-10-6-15(7-11-17)18-8-4-3-5-9-18/h14-16,19H,3-13H2,1-2H3.
What are the key properties of 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol?
1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol has a molecular weight of 284.44 g/mol, XLogP of 1.72, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-piperidin-1-ylpiperidin-1-yl)-3-propan-2-yloxypropan-2-ol is sourced from PubChem (CID 60966443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).