1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol

C11H23NO2 — CID 2945868

IUPAC1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)CN1CCCCC1
InChIInChI=1S/C11H23NO2/c1-10(2)14-9-11(13)8-12-6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3
InChIKeyCXKIBZQUUMGOCK-UHFFFAOYSA-N
MW201.31 g/mol
LogP1.26
Rot. Bonds5

About 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol

1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol (PubChem CID 2945868) has the molecular formula C11H23NO2 and a molecular weight of 201.31 g/mol. Its IUPAC name is 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol.

Molecular Properties

Compound Name1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol
PubChem CID2945868
Molecular FormulaC11H23NO2
Molecular Weight201.31 g/mol
Exact Mass201.17
IUPAC Name1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol
SMILESCC(C)OCC(O)CN1CCCCC1
InChIInChI=1S/C11H23NO2/c1-10(2)14-9-11(13)8-12-6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3
InChIKeyCXKIBZQUUMGOCK-UHFFFAOYSA-N
XLogP1.26
TPSA32.70 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 51.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

3-Piperidinopropane-1,2-diol
CID 97824
1-Butoxy-3-(morpholin-4-yl)propan-2-ol
CID 215187
1-[2-(2-Hydroxyethoxy)Ethyl]Piperidine
CID 4455977
1-(4-Ethyl-1-piperazinyl)-3-isopropoxy-2-propanol dihydrochloride
CID 11958894
2-Propanol, 1-cyclohexyloxy-(1-piperidyl)-
CID 566776
2-Propanol, 1-butoxy-3-(diethylamino)-
CID 208770
4-(Morpholin-4-yl)butan-2-ol
CID 14555601
1-Butoxy-3-(piperidin-1-yl)propan-2-ol
CID 566700
(4-Methyl-2-morpholinyl)methanol
CID 13949887
4,4-Dimethoxy-1-methylpiperidin-3-ol
CID 13359910
1-Methoxy-3-(morpholin-4-yl)propan-2-ol
CID 4645420
(4-(2-Methylpropyl)morpholin-2-yl)methanol
CID 16769143

Frequently Asked Questions

What is the IUPAC name of 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol?
The IUPAC name of 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol (CID 2945868) is 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol.
What is the SMILES notation for 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol?
The canonical SMILES for 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol is CC(C)OCC(O)CN1CCCCC1.
What is the InChIKey of 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol?
The InChIKey is CXKIBZQUUMGOCK-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H23NO2/c1-10(2)14-9-11(13)8-12-6-4-3-5-7-12/h10-11,13H,3-9H2,1-2H3.
What are the key properties of 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol?
1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol has a molecular weight of 201.31 g/mol, XLogP of 1.26, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-piperidin-1-yl-3-propan-2-yloxypropan-2-ol is sourced from PubChem (CID 2945868), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).