[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine

C14H21N — CID 28937935

IUPAC[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine
SMILESCC(C)c1ccc(C2(CN)CCC2)cc1
InChIInChI=1S/C14H21N/c1-11(2)12-4-6-13(7-5-12)14(10-15)8-3-9-14/h4-7,11H,3,8-10,15H2,1-2H3
InChIKeyPTDJKLCIESCKFG-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.19
Rot. Bonds3

About [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine

[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine (PubChem CID 28937935) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine
PubChem CID28937935
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine
SMILESCC(C)c1ccc(C2(CN)CCC2)cc1
InChIInChI=1S/C14H21N/c1-11(2)12-4-6-13(7-5-12)14(10-15)8-3-9-14/h4-7,11H,3,8-10,15H2,1-2H3
InChIKeyPTDJKLCIESCKFG-UHFFFAOYSA-N
XLogP3.19
TPSA26.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 53.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

1-[1-(chloromethyl)cyclopentyl]-4-propan-2-ylbenzene
CID 82083786
1-[4-[1-(aminomethyl)cyclobutyl]phenyl]ethane-1,2-diol
CID 117316559
[3-propan-2-yl-1-(4-propan-2-ylphenyl)cyclobutyl]methanamine
CID 65017231
[1-[2,5-di(propan-2-yl)phenyl]cyclobutyl]methanamine
CID 117366355
[1-[4-(1,2-dimethoxyethyl)phenyl]cyclobutyl]methanamine
CID 117377033
[1-(4-tert-butylphenyl)cyclobutyl]methanamine
CID 43378542
1-(4-propan-2-ylphenyl)cyclobutan-1-amine
CID 43146614
2-methyl-N-[[1-(4-propan-2-ylphenyl)cyclohexyl]methyl]propan-1-amine
CID 63509928
[1-(4-chlorophenyl)cycloheptyl]methanamine
CID 28937852
[1-(4-ethylphenyl)cyclopentyl]methanamine
CID 82491828
[1-(3-fluoro-5-propan-2-ylphenyl)cyclopentyl]methanamine
CID 84797654
1-[3-[1-(aminomethyl)cyclobutyl]phenyl]ethanol
CID 117113123

Frequently Asked Questions

What is the IUPAC name of [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine?
The IUPAC name of [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine (CID 28937935) is [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine.
What is the SMILES notation for [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine?
The canonical SMILES for [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine is CC(C)c1ccc(C2(CN)CCC2)cc1.
What is the InChIKey of [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine?
The InChIKey is PTDJKLCIESCKFG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-11(2)12-4-6-13(7-5-12)14(10-15)8-3-9-14/h4-7,11H,3,8-10,15H2,1-2H3.
What are the key properties of [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine?
[1-(4-propan-2-ylphenyl)cyclobutyl]methanamine has a molecular weight of 203.33 g/mol, XLogP of 3.19, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(4-propan-2-ylphenyl)cyclobutyl]methanamine is sourced from PubChem (CID 28937935), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).