6-(4-aminopiperidin-1-yl)hexan-1-ol

C22H48N4O2 — CID 70276836

IUPAC6-(4-aminopiperidin-1-yl)hexan-1-ol
SMILESNC1CCN(CCCCCCO)CC1.NC1CCN(CCCCCCO)CC1
InChIInChI=1S/2C11H24N2O/c2*12-11-5-8-13(9-6-11)7-3-1-2-4-10-14/h2*11,14H,1-10,12H2
InChIKeyLQBMRFLWUGBPNM-UHFFFAOYSA-N
MW400.65 g/mol
LogP1.92
Rot. Bonds12

About 6-(4-aminopiperidin-1-yl)hexan-1-ol

6-(4-aminopiperidin-1-yl)hexan-1-ol (PubChem CID 70276836) has the molecular formula C22H48N4O2 and a molecular weight of 400.65 g/mol. Its IUPAC name is 6-(4-aminopiperidin-1-yl)hexan-1-ol.

Molecular Properties

Compound Name6-(4-aminopiperidin-1-yl)hexan-1-ol
PubChem CID70276836
Molecular FormulaC22H48N4O2
Molecular Weight400.65 g/mol
Exact Mass400.38
IUPAC Name6-(4-aminopiperidin-1-yl)hexan-1-ol
SMILESNC1CCN(CCCCCCO)CC1.NC1CCN(CCCCCCO)CC1
InChIInChI=1S/2C11H24N2O/c2*12-11-5-8-13(9-6-11)7-3-1-2-4-10-14/h2*11,14H,1-10,12H2
InChIKeyLQBMRFLWUGBPNM-UHFFFAOYSA-N
XLogP1.92
TPSA98.98 Ų
H-Bond Donors4
H-Bond Acceptors6
Rotatable Bonds12
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500400.65
LogP ≤ 51.92
H-Bond Donors ≤ 54
H-Bond Acceptors ≤ 106

Computed Properties (RDKit)

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

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Related Compounds

6-[4-(hydroxymethyl)piperidin-1-yl]hexan-1-ol
CID 103737785
2-(4-aminopiperidin-1-yl)ethanol
CID 15733445
2-[1-(5-hydroxypentyl)piperidin-4-yl]acetamide
CID 62228799
4-(4-aminopiperidin-1-yl)butanamide
CID 118533814
6-[3-(aminomethyl)pyrrolidin-1-yl]hexan-1-ol
CID 103815424
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol
CID 103738002
ethane;1-pentylpiperidin-4-amine
CID 142516102
1-(6-methoxyhexyl)piperidin-4-amine
CID 18001881
4-(4-octylpiperidin-1-yl)butan-1-ol
CID 71395098
4-(4-nonylpiperidin-1-yl)butan-1-ol
CID 71395100
4-(4-octylpiperidin-1-yl)butan-1-ol;hydrochloride
CID 71395097
5-(4-hexylpiperidin-1-yl)pentan-1-ol;hydrochloride
CID 23328916

Frequently Asked Questions

What is the IUPAC name of 6-(4-aminopiperidin-1-yl)hexan-1-ol?
The IUPAC name of 6-(4-aminopiperidin-1-yl)hexan-1-ol (CID 70276836) is 6-(4-aminopiperidin-1-yl)hexan-1-ol.
What is the SMILES notation for 6-(4-aminopiperidin-1-yl)hexan-1-ol?
The canonical SMILES for 6-(4-aminopiperidin-1-yl)hexan-1-ol is NC1CCN(CCCCCCO)CC1.NC1CCN(CCCCCCO)CC1.
What is the InChIKey of 6-(4-aminopiperidin-1-yl)hexan-1-ol?
The InChIKey is LQBMRFLWUGBPNM-UHFFFAOYSA-N. The full InChI is InChI=1S/2C11H24N2O/c2*12-11-5-8-13(9-6-11)7-3-1-2-4-10-14/h2*11,14H,1-10,12H2.
What are the key properties of 6-(4-aminopiperidin-1-yl)hexan-1-ol?
6-(4-aminopiperidin-1-yl)hexan-1-ol has a molecular weight of 400.65 g/mol, XLogP of 1.92, 12 rotatable bonds, 4 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(4-aminopiperidin-1-yl)hexan-1-ol is sourced from PubChem (CID 70276836), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).