6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol

C15H33N3O — CID 107703012

IUPAC6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol
SMILESCCCC(CN)N1CCN(CCCCCCO)CC1
InChIInChI=1S/C15H33N3O/c1-2-7-15(14-16)18-11-9-17(10-12-18)8-5-3-4-6-13-19/h15,19H,2-14,16H2,1H3
InChIKeyFTARCOKOIPAJKA-UHFFFAOYSA-N
MW271.45 g/mol
LogP1.28
Rot. Bonds10

About 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol

6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol (PubChem CID 107703012) has the molecular formula C15H33N3O and a molecular weight of 271.45 g/mol. Its IUPAC name is 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol.

Molecular Properties

Compound Name6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol
PubChem CID107703012
Molecular FormulaC15H33N3O
Molecular Weight271.45 g/mol
Exact Mass271.26
IUPAC Name6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol
SMILESCCCC(CN)N1CCN(CCCCCCO)CC1
InChIInChI=1S/C15H33N3O/c1-2-7-15(14-16)18-11-9-17(10-12-18)8-5-3-4-6-13-19/h15,19H,2-14,16H2,1H3
InChIKeyFTARCOKOIPAJKA-UHFFFAOYSA-N
XLogP1.28
TPSA52.73 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.45
LogP ≤ 51.28
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

4-[4-(1-aminopentan-2-yl)piperazin-1-yl]butan-1-ol
CID 55202942
2-[4-(5-hydroxypentyl)piperazin-1-yl]pentanethioamide
CID 63341676
2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]pentan-1-amine
CID 62885074
3-[4-(1-aminopentan-2-yl)piperazin-1-yl]-N-propan-2-ylpropanamide
CID 63340321
5-(4-propan-2-ylpiperazin-1-yl)pentan-1-ol
CID 22218549
2-[4-(3-imidazol-1-ylpropyl)piperazin-1-yl]pentan-1-amine
CID 63343574
5-[4-(3-amino-2-methylpropyl)piperazin-1-yl]pentan-1-ol
CID 62227302
2-[4-(1-aminopentan-2-yl)piperazin-1-yl]-N-methyl-N-propan-2-ylacetamide
CID 63343968
2-[4-[2-(dimethylamino)ethyl]piperazin-1-yl]octan-1-amine
CID 62886437
2-[4-(1-aminopentan-2-yl)piperazin-1-yl]-N-(3-methylbutan-2-yl)acetamide
CID 63343532
4-[4-(5-methylheptyl)piperazin-1-yl]butan-1-ol
CID 156729440
2-[4-(6-hydroxyhexyl)piperazin-1-yl]butanethioamide
CID 107703812

Frequently Asked Questions

What is the IUPAC name of 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol?
The IUPAC name of 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol (CID 107703012) is 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol.
What is the SMILES notation for 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol?
The canonical SMILES for 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol is CCCC(CN)N1CCN(CCCCCCO)CC1.
What is the InChIKey of 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol?
The InChIKey is FTARCOKOIPAJKA-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H33N3O/c1-2-7-15(14-16)18-11-9-17(10-12-18)8-5-3-4-6-13-19/h15,19H,2-14,16H2,1H3.
What are the key properties of 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol?
6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol has a molecular weight of 271.45 g/mol, XLogP of 1.28, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-(1-aminopentan-2-yl)piperazin-1-yl]hexan-1-ol is sourced from PubChem (CID 107703012), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).