[1-(3-cyclobutylphenyl)cyclobutyl]methanamine

C15H21N — CID 117307162

IUPAC[1-(3-cyclobutylphenyl)cyclobutyl]methanamine
SMILESNCC1(c2cccc(C3CCC3)c2)CCC1
InChIInChI=1S/C15H21N/c16-11-15(8-3-9-15)14-7-2-6-13(10-14)12-4-1-5-12/h2,6-7,10,12H,1,3-5,8-9,11,16H2
InChIKeyYYYPAVIPMAVWGR-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.33
Rot. Bonds3

About [1-(3-cyclobutylphenyl)cyclobutyl]methanamine

[1-(3-cyclobutylphenyl)cyclobutyl]methanamine (PubChem CID 117307162) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is [1-(3-cyclobutylphenyl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-(3-cyclobutylphenyl)cyclobutyl]methanamine
PubChem CID117307162
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name[1-(3-cyclobutylphenyl)cyclobutyl]methanamine
SMILESNCC1(c2cccc(C3CCC3)c2)CCC1
InChIInChI=1S/C15H21N/c16-11-15(8-3-9-15)14-7-2-6-13(10-14)12-4-1-5-12/h2,6-7,10,12H,1,3-5,8-9,11,16H2
InChIKeyYYYPAVIPMAVWGR-UHFFFAOYSA-N
XLogP3.33
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.33
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

[1-[3-(oxetan-3-yl)phenyl]cyclobutyl]methanamine
CID 117309887
[1-(3-pyrrolidin-3-ylphenyl)cyclobutyl]methanamine
CID 84793975
[1-[3-(1-methylazepan-4-yl)phenyl]cyclopropyl]methanamine
CID 117399945
[1-[3-(3,3-dimethylcyclohexyl)phenyl]cyclopropyl]methanamine
CID 117397255
[1-(4-cyclobutylphenyl)cyclopropyl]methanamine
CID 117290330
1-(3-cycloheptylphenyl)cyclopentan-1-amine
CID 117397299
[1-(3-methylphenyl)-4-(5,6,7,8-tetrahydronaphthalen-2-yl)cyclohexyl]methanamine
CID 70294454
[1-[3-(difluoromethyl)phenyl]cyclobutyl]methanamine
CID 117301607
3-[1-(aminomethyl)cyclobutyl]-N,N-dimethylaniline
CID 82609365
1-[3-[1-(aminomethyl)cyclobutyl]phenyl]ethanol
CID 117113123
3-amino-1-(3-cyclobutylphenyl)cyclobutan-1-ol
CID 114601502
[1-(aminomethyl)-4-methylcyclohexyl]-(3-cyclobutylphenyl)methanone
CID 114607743

Frequently Asked Questions

What is the IUPAC name of [1-(3-cyclobutylphenyl)cyclobutyl]methanamine?
The IUPAC name of [1-(3-cyclobutylphenyl)cyclobutyl]methanamine (CID 117307162) is [1-(3-cyclobutylphenyl)cyclobutyl]methanamine.
What is the SMILES notation for [1-(3-cyclobutylphenyl)cyclobutyl]methanamine?
The canonical SMILES for [1-(3-cyclobutylphenyl)cyclobutyl]methanamine is NCC1(c2cccc(C3CCC3)c2)CCC1.
What is the InChIKey of [1-(3-cyclobutylphenyl)cyclobutyl]methanamine?
The InChIKey is YYYPAVIPMAVWGR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c16-11-15(8-3-9-15)14-7-2-6-13(10-14)12-4-1-5-12/h2,6-7,10,12H,1,3-5,8-9,11,16H2.
What are the key properties of [1-(3-cyclobutylphenyl)cyclobutyl]methanamine?
[1-(3-cyclobutylphenyl)cyclobutyl]methanamine has a molecular weight of 215.34 g/mol, XLogP of 3.33, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(3-cyclobutylphenyl)cyclobutyl]methanamine is sourced from PubChem (CID 117307162), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).