3-[3-(methylamino)cyclobutyl]phenol

C11H15NO — CID 105437059

IUPAC3-[3-(methylamino)cyclobutyl]phenol
SMILESCNC1CC(c2cccc(O)c2)C1
InChIInChI=1S/C11H15NO/c1-12-10-5-9(6-10)8-3-2-4-11(13)7-8/h2-4,7,9-10,12-13H,5-6H2,1H3
InChIKeyBPSAJCCOCZLZNE-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.86
Rot. Bonds2

About 3-[3-(methylamino)cyclobutyl]phenol

3-[3-(methylamino)cyclobutyl]phenol (PubChem CID 105437059) has the molecular formula C11H15NO and a molecular weight of 177.25 g/mol. Its IUPAC name is 3-[3-(methylamino)cyclobutyl]phenol.

Molecular Properties

Compound Name3-[3-(methylamino)cyclobutyl]phenol
PubChem CID105437059
Molecular FormulaC11H15NO
Molecular Weight177.25 g/mol
Exact Mass177.12
IUPAC Name3-[3-(methylamino)cyclobutyl]phenol
SMILESCNC1CC(c2cccc(O)c2)C1
InChIInChI=1S/C11H15NO/c1-12-10-5-9(6-10)8-3-2-4-11(13)7-8/h2-4,7,9-10,12-13H,5-6H2,1H3
InChIKeyBPSAJCCOCZLZNE-UHFFFAOYSA-N
XLogP1.86
TPSA32.26 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.86
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

3-(8-azabicyclo[3.2.1]octan-3-yl)phenol;hydrobromide
CID 67026991
3-cyclohexylphenol
CID 16036
3-[4-(4-hydroxyphenyl)cyclohexyl]phenol
CID 167227782
3-(5-methylpyrrolidin-3-yl)phenol;hydrochloride
CID 161066750
N,3-dimethyl-5-phenylcyclohexan-1-amine
CID 115707725
3-(2,2-dimethyloxan-4-yl)phenol
CID 155395042
4-[[3-(3-chlorophenyl)cyclobutyl]amino]phenol
CID 43742874
N-[3-(3-fluorophenyl)cyclobutyl]hydroxylamine
CID 82686213
3-pyrrolidin-3-ylphenol
CID 12937992
N-methyl-3-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclobutan-1-amine
CID 156864691
3-[6-fluoro-4-(methylamino)-3,4-dihydro-2H-chromen-2-yl]phenol
CID 114710520
3-[6,8,10,18,22,24,26-heptakis(3-hydroxyphenyl)-20,28-bis(4-hydroxyphenyl)-2,12,17,30-tetramethyl-4-tricyclo[29.2.2.213,16]heptatriaconta-1(34),13,15,31(35),32,36-hexaenyl]phenol;methane;nonatriacontahydrate
CID 161313163

Frequently Asked Questions

What is the IUPAC name of 3-[3-(methylamino)cyclobutyl]phenol?
The IUPAC name of 3-[3-(methylamino)cyclobutyl]phenol (CID 105437059) is 3-[3-(methylamino)cyclobutyl]phenol.
What is the SMILES notation for 3-[3-(methylamino)cyclobutyl]phenol?
The canonical SMILES for 3-[3-(methylamino)cyclobutyl]phenol is CNC1CC(c2cccc(O)c2)C1.
What is the InChIKey of 3-[3-(methylamino)cyclobutyl]phenol?
The InChIKey is BPSAJCCOCZLZNE-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15NO/c1-12-10-5-9(6-10)8-3-2-4-11(13)7-8/h2-4,7,9-10,12-13H,5-6H2,1H3.
What are the key properties of 3-[3-(methylamino)cyclobutyl]phenol?
3-[3-(methylamino)cyclobutyl]phenol has a molecular weight of 177.25 g/mol, XLogP of 1.86, 2 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 3-[3-(methylamino)cyclobutyl]phenol is sourced from PubChem (CID 105437059), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).