1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol

C14H30N2O — CID 83990235

IUPAC1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol
SMILESCCCN1CC(CC(O)CC)CC(NCC)C1
InChIInChI=1S/C14H30N2O/c1-4-7-16-10-12(9-14(17)5-2)8-13(11-16)15-6-3/h12-15,17H,4-11H2,1-3H3
InChIKeyBJBOALXIUODOFZ-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.86
Rot. Bonds7

About 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol

1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol (PubChem CID 83990235) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol.

Molecular Properties

Compound Name1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol
PubChem CID83990235
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol
SMILESCCCN1CC(CC(O)CC)CC(NCC)C1
InChIInChI=1S/C14H30N2O/c1-4-7-16-10-12(9-14(17)5-2)8-13(11-16)15-6-3/h12-15,17H,4-11H2,1-3H3
InChIKeyBJBOALXIUODOFZ-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500242.41
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

1-[5-(cyclobutylmethylamino)-1-propylpiperidin-3-yl]butan-2-ol
CID 83996988
1-[1-(2-aminoethyl)-5-(cyclopropylmethylamino)piperidin-3-yl]butan-2-ol
CID 83996881
1-[1-(2-aminoethyl)-5-(cyclopentylmethylamino)piperidin-3-yl]butan-2-ol
CID 83998265
N-[5-(2-hydroxybutyl)-1-(2-hydroxyethyl)piperidin-3-yl]acetamide
CID 112542070
1-[1-(2-aminoethyl)-5-(ethylamino)piperidin-3-yl]-3-methylbutan-2-ol
CID 83990765
1-cyclopropyl-2-[5-(ethylamino)-1-(2-hydroxyethyl)piperidin-3-yl]ethanol
CID 83990741
1-[1-(cyclopropylmethyl)-5-(2,2,2-trifluoroethylamino)piperidin-3-yl]butan-2-ol
CID 83992539
2-[3-(2,2-difluoroethylamino)-5-(2-hydroxybutyl)piperidin-1-yl]acetonitrile
CID 83993358
2-[3-(2-hydroxybutyl)-5-(2-methylpropylamino)piperidin-1-yl]acetamide
CID 83994764
methyl 3-[5-(ethylamino)-1-propylpiperidin-3-yl]propanoate
CID 83990231
1-cyclopropyl-2-[5-(cyclopropylamino)-1-propylpiperidin-3-yl]ethanol
CID 83991509
1-[5-(cyclopentylmethylamino)-1-methylpiperidin-3-yl]butan-2-ol
CID 83997612

Frequently Asked Questions

What is the IUPAC name of 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol?
The IUPAC name of 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol (CID 83990235) is 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol.
What is the SMILES notation for 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol?
The canonical SMILES for 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol is CCCN1CC(CC(O)CC)CC(NCC)C1.
What is the InChIKey of 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol?
The InChIKey is BJBOALXIUODOFZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-4-7-16-10-12(9-14(17)5-2)8-13(11-16)15-6-3/h12-15,17H,4-11H2,1-3H3.
What are the key properties of 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol?
1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol has a molecular weight of 242.41 g/mol, XLogP of 1.86, 7 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-[5-(ethylamino)-1-propylpiperidin-3-yl]butan-2-ol is sourced from PubChem (CID 83990235), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).