6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol

C14H30N2O — CID 107701930

IUPAC6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol
SMILESCNC(C)C1CCCN(CCCCCCO)C1
InChIInChI=1S/C14H30N2O/c1-13(15-2)14-8-7-10-16(12-14)9-5-3-4-6-11-17/h13-15,17H,3-12H2,1-2H3
InChIKeyCHCSOIZWZBOIKJ-UHFFFAOYSA-N
MW242.41 g/mol
LogP1.86
Rot. Bonds8

About 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol

6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol (PubChem CID 107701930) has the molecular formula C14H30N2O and a molecular weight of 242.41 g/mol. Its IUPAC name is 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol.

Molecular Properties

Compound Name6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol
PubChem CID107701930
Molecular FormulaC14H30N2O
Molecular Weight242.41 g/mol
Exact Mass242.24
IUPAC Name6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol
SMILESCNC(C)C1CCCN(CCCCCCO)C1
InChIInChI=1S/C14H30N2O/c1-13(15-2)14-8-7-10-16(12-14)9-5-3-4-6-11-17/h13-15,17H,3-12H2,1-2H3
InChIKeyCHCSOIZWZBOIKJ-UHFFFAOYSA-N
XLogP1.86
TPSA35.50 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds8
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

Computed Properties (RDKit)

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

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Related Compounds

N-methyl-4-[3-[1-(methylamino)ethyl]piperidin-1-yl]butanamide
CID 63891364
1-[1-(3,3-dimethylbutyl)piperidin-3-yl]-N-methylethanamine
CID 63855330
3-[3-(1-methoxyethyl)piperidin-1-yl]propan-1-ol
CID 67282023
N-cyclopropyl-2-[3-[1-(methylamino)ethyl]piperidin-1-yl]acetamide
CID 63854794
N-methyl-1-[1-(3-phenoxypropyl)piperidin-3-yl]ethanamine
CID 63854102
N-ethyl-1-(1-pentylpiperidin-3-yl)ethanamine
CID 63852706
N-methyl-1-[1-[2-(1-methylpiperidin-2-yl)ethyl]piperidin-3-yl]ethanamine
CID 107910860
N-[1-(5-hydroxypentyl)azepan-4-yl]-2-methylpropanamide
CID 154671313
5-[3-(hydroxymethyl)piperidin-1-yl]pentan-1-ol
CID 62229344
6-(4-propan-2-ylpiperidin-1-yl)hexan-1-ol
CID 103738002
6-[2-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol
CID 107701936
5-[3-(ethylaminomethyl)piperidin-1-yl]pentan-1-ol
CID 63848813

Frequently Asked Questions

What is the IUPAC name of 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol?
The IUPAC name of 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol (CID 107701930) is 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol.
What is the SMILES notation for 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol?
The canonical SMILES for 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol is CNC(C)C1CCCN(CCCCCCO)C1.
What is the InChIKey of 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol?
The InChIKey is CHCSOIZWZBOIKJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O/c1-13(15-2)14-8-7-10-16(12-14)9-5-3-4-6-11-17/h13-15,17H,3-12H2,1-2H3.
What are the key properties of 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol?
6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol has a molecular weight of 242.41 g/mol, XLogP of 1.86, 8 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[3-[1-(methylamino)ethyl]piperidin-1-yl]hexan-1-ol is sourced from PubChem (CID 107701930), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).