1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol

C11H24N2O — CID 83988996

IUPAC1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol
SMILESCCC(O)CC1CC(N)CN(CC)C1
InChIInChI=1S/C11H24N2O/c1-3-11(14)6-9-5-10(12)8-13(4-2)7-9/h9-11,14H,3-8,12H2,1-2H3
InChIKeyYFMIQHPQWSEMOJ-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.82
Rot. Bonds4

About 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol

1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol (PubChem CID 83988996) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol.

Molecular Properties

Compound Name1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol
PubChem CID83988996
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol
SMILESCCC(O)CC1CC(N)CN(CC)C1
InChIInChI=1S/C11H24N2O/c1-3-11(14)6-9-5-10(12)8-13(4-2)7-9/h9-11,14H,3-8,12H2,1-2H3
InChIKeyYFMIQHPQWSEMOJ-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

1-[5-amino-1-(2-aminoethyl)piperidin-3-yl]butan-2-ol
CID 83989506
1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol
CID 83990235
1-[1-(2-aminoethyl)-5-(cyclopropylmethylamino)piperidin-3-yl]butan-2-ol
CID 83996881
1-[1-cyclopropyl-5-(methylamino)piperidin-3-yl]butan-2-ol
CID 83989886
2-[3-(2-hydroxybutyl)-5-(2-methylpropylamino)piperidin-1-yl]acetamide
CID 83994764
1-[1-(2-aminoethyl)-5-(cyclopentylmethylamino)piperidin-3-yl]butan-2-ol
CID 83998265
1-[1-(cyclopropylmethyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]butan-2-ol
CID 83992539
1-[5-(cyclobutylmethylamino)-1-propylpiperidin-3-yl]butan-2-ol
CID 83996988
N-[5-(2-hydroxybutyl)-1-(2-hydroxyethyl)piperidin-3-yl]acetamide
CID 112542070
2-[3-(2,2-difluoroethylamino)-5-(2-hydroxybutyl)piperidin-1-yl]acetonitrile
CID 83993358
1-[5-(cyclohexylmethylamino)-1-(2-methylpropyl)piperidin-3-yl]butan-2-ol
CID 83998394
N-[1-(cyanomethyl)-5-(2-hydroxybutyl)piperidin-3-yl]-2-methylpropanamide
CID 112542931

Frequently Asked Questions

What is the IUPAC name of 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol?
The IUPAC name of 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol (CID 83988996) is 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol.
What is the SMILES notation for 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol?
The canonical SMILES for 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol is CCC(O)CC1CC(N)CN(CC)C1.
What is the InChIKey of 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol?
The InChIKey is YFMIQHPQWSEMOJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-11(14)6-9-5-10(12)8-13(4-2)7-9/h9-11,14H,3-8,12H2,1-2H3.
What are the key properties of 1-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol?
1-(5-amino-1-ethylpiperidin-3-yl)butan-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-(5-amino-1-ethylpiperidin-3-yl)butan-2-ol is sourced from PubChem (CID 83988996), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).