4-(4-hydroxyphenyl)butyl-methylazanide

C11H16NO- — CID 59713445

IUPAC4-(4-hydroxyphenyl)butyl-methylazanide
SMILESC[N-]CCCCc1ccc(O)cc1
InChIInChI=1S/C11H16NO/c1-12-9-3-2-4-10-5-7-11(13)8-6-10/h5-8,13H,2-4,9H2,1H3/q-1
InChIKeyVDHOWOJJMZQILX-UHFFFAOYSA-N
MW178.25 g/mol
LogP2.72
Rot. Bonds5

About 4-(4-hydroxyphenyl)butyl-methylazanide

4-(4-hydroxyphenyl)butyl-methylazanide (PubChem CID 59713445) has the molecular formula C11H16NO- and a molecular weight of 178.25 g/mol. Its IUPAC name is 4-(4-hydroxyphenyl)butyl-methylazanide.

Molecular Properties

Compound Name4-(4-hydroxyphenyl)butyl-methylazanide
PubChem CID59713445
Molecular FormulaC11H16NO-
Molecular Weight178.25 g/mol
Exact Mass178.12
IUPAC Name4-(4-hydroxyphenyl)butyl-methylazanide
SMILESC[N-]CCCCc1ccc(O)cc1
InChIInChI=1S/C11H16NO/c1-12-9-3-2-4-10-5-7-11(13)8-6-10/h5-8,13H,2-4,9H2,1H3/q-1
InChIKeyVDHOWOJJMZQILX-UHFFFAOYSA-N
XLogP2.72
TPSA34.33 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds5
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.25
LogP ≤ 52.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

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

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Related Compounds

4-[11-(4-hydroxyphenyl)undecyl]phenol
CID 23191182
barium(2+);hydride;4-nonylphenol
CID 173156845
4-[2-(4-pentylphenyl)ethyl]phenol
CID 57152203
tris(4-octylphenol);propane
CID 90866185
CID 162318522
CID 162318522
nickel;4-octylphenol
CID 87833867
ethane;4-[3-[4-[4-[3-(4-hydroxyphenyl)propyl]phenyl]phenyl]propyl]phenol
CID 91387150
4-butylphenol;tungsten
CID 174758928
4-(12-hydroxydodecyl)phenol
CID 139809285
calcium;hydride;4-tetradecylphenol
CID 174582359
calcium;hydride;4-octylphenol
CID 173256756
4-(6-iodohexyl)phenol
CID 23455799

Frequently Asked Questions

What is the IUPAC name of 4-(4-hydroxyphenyl)butyl-methylazanide?
The IUPAC name of 4-(4-hydroxyphenyl)butyl-methylazanide (CID 59713445) is 4-(4-hydroxyphenyl)butyl-methylazanide.
What is the SMILES notation for 4-(4-hydroxyphenyl)butyl-methylazanide?
The canonical SMILES for 4-(4-hydroxyphenyl)butyl-methylazanide is C[N-]CCCCc1ccc(O)cc1.
What is the InChIKey of 4-(4-hydroxyphenyl)butyl-methylazanide?
The InChIKey is VDHOWOJJMZQILX-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H16NO/c1-12-9-3-2-4-10-5-7-11(13)8-6-10/h5-8,13H,2-4,9H2,1H3/q-1.
What are the key properties of 4-(4-hydroxyphenyl)butyl-methylazanide?
4-(4-hydroxyphenyl)butyl-methylazanide has a molecular weight of 178.25 g/mol, XLogP of 2.72, 5 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(4-hydroxyphenyl)butyl-methylazanide is sourced from PubChem (CID 59713445), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).