1-butyl-4-hydroxypiperazine;pyridine

C13H23N3O — CID 174854405

IUPAC1-butyl-4-hydroxypiperazine;pyridine
SMILESCCCCN1CCN(O)CC1.c1ccncc1
InChIInChI=1S/C8H18N2O.C5H5N/c1-2-3-4-9-5-7-10(11)8-6-9;1-2-4-6-5-3-1/h11H,2-8H2,1H3;1-5H
InChIKeyBYQGSSKKRJAMQL-UHFFFAOYSA-N
MW237.35 g/mol
LogP1.87
Rot. Bonds3

About 1-butyl-4-hydroxypiperazine;pyridine

1-butyl-4-hydroxypiperazine;pyridine (PubChem CID 174854405) has the molecular formula C13H23N3O and a molecular weight of 237.35 g/mol. Its IUPAC name is 1-butyl-4-hydroxypiperazine;pyridine.

Molecular Properties

Compound Name1-butyl-4-hydroxypiperazine;pyridine
PubChem CID174854405
Molecular FormulaC13H23N3O
Molecular Weight237.35 g/mol
Exact Mass237.18
IUPAC Name1-butyl-4-hydroxypiperazine;pyridine
SMILESCCCCN1CCN(O)CC1.c1ccncc1
InChIInChI=1S/C8H18N2O.C5H5N/c1-2-3-4-9-5-7-10(11)8-6-9;1-2-4-6-5-3-1/h11H,2-8H2,1H3;1-5H
InChIKeyBYQGSSKKRJAMQL-UHFFFAOYSA-N
XLogP1.87
TPSA39.60 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500237.35
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

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1-butyl-4-methylpiperazine;ethane;2-methylpyridine
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1-benzyl-4-butylpiperazine;ethane
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1-octylaziridine
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1,4,7-tridodecyl-1,4,7-triazonane
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3-(4-butylpiperazin-1-yl)propan-1-amine
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1-butylazetidine;ethane
CID 143628082
1-benzhydryl-4-butylpiperazine
CID 13416419
3-(4-butylpiperazin-1-yl)-N-[3-(4-butylpiperazin-1-yl)propyl]propan-1-amine
CID 69028178

Frequently Asked Questions

What is the IUPAC name of 1-butyl-4-hydroxypiperazine;pyridine?
The IUPAC name of 1-butyl-4-hydroxypiperazine;pyridine (CID 174854405) is 1-butyl-4-hydroxypiperazine;pyridine.
What is the SMILES notation for 1-butyl-4-hydroxypiperazine;pyridine?
The canonical SMILES for 1-butyl-4-hydroxypiperazine;pyridine is CCCCN1CCN(O)CC1.c1ccncc1.
What is the InChIKey of 1-butyl-4-hydroxypiperazine;pyridine?
The InChIKey is BYQGSSKKRJAMQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H18N2O.C5H5N/c1-2-3-4-9-5-7-10(11)8-6-9;1-2-4-6-5-3-1/h11H,2-8H2,1H3;1-5H.
What are the key properties of 1-butyl-4-hydroxypiperazine;pyridine?
1-butyl-4-hydroxypiperazine;pyridine has a molecular weight of 237.35 g/mol, XLogP of 1.87, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-butyl-4-hydroxypiperazine;pyridine is sourced from PubChem (CID 174854405), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).