4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol

C11H24N2O — CID 63764428

IUPAC4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol
SMILESNCCC1CCCN(CCCCO)C1
InChIInChI=1S/C11H24N2O/c12-6-5-11-4-3-8-13(10-11)7-1-2-9-14/h11,14H,1-10,12H2
InChIKeyFUOWQOZLXUDRMJ-UHFFFAOYSA-N
MW200.33 g/mol
LogP0.82
Rot. Bonds6

About 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol

4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol (PubChem CID 63764428) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol.

Molecular Properties

Compound Name4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol
PubChem CID63764428
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol
SMILESNCCC1CCCN(CCCCO)C1
InChIInChI=1S/C11H24N2O/c12-6-5-11-4-3-8-13(10-11)7-1-2-9-14/h11,14H,1-10,12H2
InChIKeyFUOWQOZLXUDRMJ-UHFFFAOYSA-N
XLogP0.82
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
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

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

2-(1-heptylpiperidin-3-yl)ethanamine
CID 63764597
5-[3-(hydroxymethyl)piperidin-1-yl]pentan-1-ol
CID 62229344
2-[1-(2-fluoroethyl)piperidin-3-yl]ethanamine
CID 80695268
6-[3-(aminomethyl)pyrrolidin-1-yl]hexan-1-ol
CID 103815424
5-[3-(ethylaminomethyl)piperidin-1-yl]pentan-1-ol
CID 63848813
4-[3-(ethoxymethyl)piperidin-1-yl]butan-1-ol
CID 111148113
2-[1-[2-(2,2,2-trifluoroethoxy)ethyl]piperidin-3-yl]ethanamine
CID 63762470
2-(1-propylpiperidin-3-yl)ethanol
CID 22987971
2-[1-(2-aminoethyl)pyrrolidin-3-yl]ethanamine
CID 83963140
4-(1-methylpiperidin-3-yl)butan-1-ol
CID 70064070
1,3-di(tridecyl)piperidine
CID 162511834
3-butyl-1-dodecylpiperidine
CID 171569666

Frequently Asked Questions

What is the IUPAC name of 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol?
The IUPAC name of 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol (CID 63764428) is 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol.
What is the SMILES notation for 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol?
The canonical SMILES for 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol is NCCC1CCCN(CCCCO)C1.
What is the InChIKey of 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol?
The InChIKey is FUOWQOZLXUDRMJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c12-6-5-11-4-3-8-13(10-11)7-1-2-9-14/h11,14H,1-10,12H2.
What are the key properties of 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol?
4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol has a molecular weight of 200.33 g/mol, XLogP of 0.82, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[3-(2-aminoethyl)piperidin-1-yl]butan-1-ol is sourced from PubChem (CID 63764428), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).