1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol

C11H24N2O — CID 69368166

IUPAC1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol
SMILESCC(C)C1CCCCN1CC(O)CN
InChIInChI=1S/C11H24N2O/c1-9(2)11-5-3-4-6-13(11)8-10(14)7-12/h9-11,14H,3-8,12H2,1-2H3
InChIKeySZEQPLNUIMMXJA-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.82
Rot. Bonds4

About 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol

1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol (PubChem CID 69368166) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol.

Molecular Properties

Compound Name1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol
PubChem CID69368166
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol
SMILESCC(C)C1CCCCN1CC(O)CN
InChIInChI=1S/C11H24N2O/c1-9(2)11-5-3-4-6-13(11)8-10(14)7-12/h9-11,14H,3-8,12H2,1-2H3
InChIKeySZEQPLNUIMMXJA-UHFFFAOYSA-N
XLogP0.82
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 50.82
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

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1-(oxolan-2-ylmethoxy)-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol
CID 111424785
1-amino-3-(4-propan-2-ylpiperidin-1-yl)propan-2-ol
CID 103494900
1-[2-(1-hydroxyethyl)piperidin-1-yl]-3-[(2-methylpropan-2-yl)oxy]propan-2-ol
CID 111107375
(2S)-1-(2,3,4,4a,5,6,7,7a-octahydrocyclopenta[b]pyridin-1-yl)-3-aminopropan-2-ol
CID 130492481
1-methoxy-3-[2-[1-(methylamino)ethyl]piperidin-1-yl]propan-2-ol
CID 63931055
1-[2-[1-(propylamino)ethyl]piperidin-1-yl]butan-2-ol
CID 63853660
1-ethyl-2-propan-2-ylpyrrolidine;(2S)-1-ethyl-2-propan-2-ylpyrrolidine;(2R)-1-ethyl-2-propan-2-ylpyrrolidine
CID 161279847
4-[2-amino-1-[1-(2-methylpropyl)piperidin-2-yl]ethyl]phenol
CID 83987245
(2S)-1-[(2R)-2-[(1S)-1-hydroxypropyl]piperidin-1-yl]-3-(4-methylpiperidin-1-yl)propan-2-ol
CID 99846844
(2S)-1-amino-3-(azonan-1-yl)propan-2-ol
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Frequently Asked Questions

What is the IUPAC name of 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol?
The IUPAC name of 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol (CID 69368166) is 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol.
What is the SMILES notation for 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol?
The canonical SMILES for 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol is CC(C)C1CCCCN1CC(O)CN.
What is the InChIKey of 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol?
The InChIKey is SZEQPLNUIMMXJA-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-9(2)11-5-3-4-6-13(11)8-10(14)7-12/h9-11,14H,3-8,12H2,1-2H3.
What are the key properties of 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol?
1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol has a molecular weight of 200.33 g/mol, XLogP of 0.82, 4 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-amino-3-(2-propan-2-ylpiperidin-1-yl)propan-2-ol is sourced from PubChem (CID 69368166), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).