6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol

C12H26N2O — CID 107707010

IUPAC6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol
SMILESNCCN(CCCCCCO)C1CCC1
InChIInChI=1S/C12H26N2O/c13-8-10-14(12-6-5-7-12)9-3-1-2-4-11-15/h12,15H,1-11,13H2
InChIKeyRWEJMNSNBHLUSG-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.35
Rot. Bonds9

About 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol

6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol (PubChem CID 107707010) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol.

Molecular Properties

Compound Name6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol
PubChem CID107707010
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC Name6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol
SMILESNCCN(CCCCCCO)C1CCC1
InChIInChI=1S/C12H26N2O/c13-8-10-14(12-6-5-7-12)9-3-1-2-4-11-15/h12,15H,1-11,13H2
InChIKeyRWEJMNSNBHLUSG-UHFFFAOYSA-N
XLogP1.35
TPSA49.49 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.35
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

4-[cyclobutyl(3-hydroxypropyl)amino]butan-1-ol
CID 102848477
N'-cyclohexyl-N'-hexylethane-1,2-diamine
CID 63760462
3-[5-bromopentyl(cyclobutyl)amino]propan-1-ol
CID 102869386
3-[cyclobutyl(2-fluoroethyl)amino]propan-1-ol
CID 102848338
N'-cyclopropyl-N'-nonylethane-1,2-diamine
CID 61349746
6-[cyclopentyl(2-methylpropyl)amino]hexan-1-ol
CID 103737867
N'-cyclopentyl-N'-hexylpropane-1,3-diamine
CID 43137589
2-[cyclopentyl(octyl)amino]ethanol
CID 62015443
N'-cyclopentyl-N'-nonylpropane-1,3-diamine
CID 43319594
6-[cyclobutyl(3-hydroxypropyl)amino]hexanehydrazide
CID 102873673
3-[cyclopropyl(6-hydroxyhexyl)amino]propanenitrile
CID 103738654
3-[cyclobutyl(4-methoxybutyl)amino]propan-1-ol
CID 102848821

Frequently Asked Questions

What is the IUPAC name of 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol?
The IUPAC name of 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol (CID 107707010) is 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol.
What is the SMILES notation for 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol?
The canonical SMILES for 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol is NCCN(CCCCCCO)C1CCC1.
What is the InChIKey of 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol?
The InChIKey is RWEJMNSNBHLUSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c13-8-10-14(12-6-5-7-12)9-3-1-2-4-11-15/h12,15H,1-11,13H2.
What are the key properties of 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol?
6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol has a molecular weight of 214.35 g/mol, XLogP of 1.35, 9 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[2-aminoethyl(cyclobutyl)amino]hexan-1-ol is sourced from PubChem (CID 107707010), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).