1-(4-methylpiperazin-1-yl)hexan-1-ol

C11H24N2O — CID 68991789

IUPAC1-(4-methylpiperazin-1-yl)hexan-1-ol
SMILESCCCCCC(O)N1CCN(C)CC1
InChIInChI=1S/C11H24N2O/c1-3-4-5-6-11(14)13-9-7-12(2)8-10-13/h11,14H,3-10H2,1-2H3
InChIKeyYYKOPMWPZWVKCP-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.13
Rot. Bonds5

About 1-(4-methylpiperazin-1-yl)hexan-1-ol

1-(4-methylpiperazin-1-yl)hexan-1-ol (PubChem CID 68991789) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is 1-(4-methylpiperazin-1-yl)hexan-1-ol.

Molecular Properties

Compound Name1-(4-methylpiperazin-1-yl)hexan-1-ol
PubChem CID68991789
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC Name1-(4-methylpiperazin-1-yl)hexan-1-ol
SMILESCCCCCC(O)N1CCN(C)CC1
InChIInChI=1S/C11H24N2O/c1-3-4-5-6-11(14)13-9-7-12(2)8-10-13/h11,14H,3-10H2,1-2H3
InChIKeyYYKOPMWPZWVKCP-UHFFFAOYSA-N
XLogP1.13
TPSA26.71 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.13
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-(3-methylimidazolidin-1-yl)tridecan-1-ol
CID 150165158
1-heptan-2-yl-4-methyl-1,4-diazepane
CID 146200465
1-heptan-2-yl-4-methylpiperazine;1-methyl-4-pentylpiperazine
CID 143197605
tetradecane-1,1-diol;tridecane-1,1-diol
CID 87487679
decane;dodecane-1,1-diol
CID 162011285
nonacosane-1,1-diol
CID 23066924
heptane-1,1-diol;hexane-1,1-diol
CID 161393558
CID 172691644
CID 172691644
dodecane-1,1-diol;dihydrochloride
CID 87128887
1-methyl-4-(3-pentylnonyl)piperazine
CID 126576998
6-[1-(4-methylpiperazin-1-yl)propyl]dodecan-1-amine
CID 174636364
1-(1,4-dimethylpiperazin-2-yl)decan-1-ol
CID 79658821

Frequently Asked Questions

What is the IUPAC name of 1-(4-methylpiperazin-1-yl)hexan-1-ol?
The IUPAC name of 1-(4-methylpiperazin-1-yl)hexan-1-ol (CID 68991789) is 1-(4-methylpiperazin-1-yl)hexan-1-ol.
What is the SMILES notation for 1-(4-methylpiperazin-1-yl)hexan-1-ol?
The canonical SMILES for 1-(4-methylpiperazin-1-yl)hexan-1-ol is CCCCCC(O)N1CCN(C)CC1.
What is the InChIKey of 1-(4-methylpiperazin-1-yl)hexan-1-ol?
The InChIKey is YYKOPMWPZWVKCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-3-4-5-6-11(14)13-9-7-12(2)8-10-13/h11,14H,3-10H2,1-2H3.
What are the key properties of 1-(4-methylpiperazin-1-yl)hexan-1-ol?
1-(4-methylpiperazin-1-yl)hexan-1-ol has a molecular weight of 200.33 g/mol, XLogP of 1.13, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methylpiperazin-1-yl)hexan-1-ol is sourced from PubChem (CID 68991789), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).