[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine

C14H21N — CID 65000759

IUPAC[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine
SMILESCCC1CC(CN)(c2cccc(C)c2)C1
InChIInChI=1S/C14H21N/c1-3-12-8-14(9-12,10-15)13-6-4-5-11(2)7-13/h4-7,12H,3,8-10,15H2,1-2H3
InChIKeyBYAWBHOATHQJQL-UHFFFAOYSA-N
MW203.33 g/mol
LogP3.01
Rot. Bonds3

About [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine

[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine (PubChem CID 65000759) has the molecular formula C14H21N and a molecular weight of 203.33 g/mol. Its IUPAC name is [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine.

Molecular Properties

Compound Name[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine
PubChem CID65000759
Molecular FormulaC14H21N
Molecular Weight203.33 g/mol
Exact Mass203.17
IUPAC Name[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine
SMILESCCC1CC(CN)(c2cccc(C)c2)C1
InChIInChI=1S/C14H21N/c1-3-12-8-14(9-12,10-15)13-6-4-5-11(2)7-13/h4-7,12H,3,8-10,15H2,1-2H3
InChIKeyBYAWBHOATHQJQL-UHFFFAOYSA-N
XLogP3.01
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 ≤ 53.01
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

N-[[3-ethyl-1-(3-methylphenyl)cyclobutyl]methyl]-2-methoxyethanamine
CID 64998082
[4-(3-methylphenyl)thian-4-yl]methanamine
CID 83822688
[3,3-dimethoxy-1-(3-methylphenyl)cyclobutyl]methanamine
CID 64906687
[4-methoxy-1-(3-methylphenyl)cyclohexyl]methanamine
CID 70298951
[1-(3-fluorophenyl)-3-propylcyclobutyl]methanamine
CID 65013573
[1-(1,3-benzodioxol-5-yl)-3-ethylcyclobutyl]methanamine
CID 65000376
[1-cyclopropyl-4-(3-methylphenyl)piperidin-4-yl]methanamine
CID 82294475
1-(3-methylphenyl)-3-propylcyclobutan-1-amine
CID 65013464
(3-ethyl-1-thiophen-2-ylcyclobutyl)methanamine
CID 65000256
1-[4-(aminomethyl)-4-(3-methylphenyl)cyclohexyl]piperazine-2,5-dione
CID 143706143
[1-(3-methylphenyl)cyclopropyl]methanol
CID 55253193
4-ethyl-4-(3-methylphenyl)oxane
CID 143442460

Frequently Asked Questions

What is the IUPAC name of [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine?
The IUPAC name of [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine (CID 65000759) is [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine.
What is the SMILES notation for [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine?
The canonical SMILES for [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine is CCC1CC(CN)(c2cccc(C)c2)C1.
What is the InChIKey of [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine?
The InChIKey is BYAWBHOATHQJQL-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H21N/c1-3-12-8-14(9-12,10-15)13-6-4-5-11(2)7-13/h4-7,12H,3,8-10,15H2,1-2H3.
What are the key properties of [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine?
[3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine has a molecular weight of 203.33 g/mol, XLogP of 3.01, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for [3-ethyl-1-(3-methylphenyl)cyclobutyl]methanamine is sourced from PubChem (CID 65000759), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).