[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine

C15H24N2 — CID 116943807

IUPAC[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine
SMILESCCCc1ccc(C(N)C2(CN)CCC2)cc1
InChIInChI=1S/C15H24N2/c1-2-4-12-5-7-13(8-6-12)14(17)15(11-16)9-3-10-15/h5-8,14H,2-4,9-11,16-17H2,1H3
InChIKeyKEWTUROUBRFBTH-UHFFFAOYSA-N
MW232.37 g/mol
LogP2.77
Rot. Bonds5

About [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine

[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine (PubChem CID 116943807) has the molecular formula C15H24N2 and a molecular weight of 232.37 g/mol. Its IUPAC name is [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine.

Molecular Properties

Compound Name[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine
PubChem CID116943807
Molecular FormulaC15H24N2
Molecular Weight232.37 g/mol
Exact Mass232.19
IUPAC Name[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine
SMILESCCCc1ccc(C(N)C2(CN)CCC2)cc1
InChIInChI=1S/C15H24N2/c1-2-4-12-5-7-13(8-6-12)14(17)15(11-16)9-3-10-15/h5-8,14H,2-4,9-11,16-17H2,1H3
InChIKeyKEWTUROUBRFBTH-UHFFFAOYSA-N
XLogP2.77
TPSA52.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 52.77
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

[1-(aminomethyl)cyclobutyl]-phenylmethanamine
CID 116943782
1-[amino-(4-propylphenyl)methyl]-N,N-dimethylcyclohexan-1-amine
CID 79067030
N-methyl-1-[1-(methylaminomethyl)cyclobutyl]-1-(4-propylphenyl)methanamine
CID 116958870
2,2-dimethyl-1-(4-propylphenyl)propan-1-amine
CID 43198125
(1S)-1-(4-propylphenyl)ethanamine
CID 7047688
1-[3-(aminomethyl)oxetan-3-yl]-N,N-dimethyl-1-(4-propylphenyl)methanamine
CID 116913035
1-[1-(aminomethyl)cyclobutyl]-1-(4-ethylphenyl)-N,N-dimethylmethanamine
CID 116912489
2-amino-2-(4-propylphenyl)acetonitrile
CID 90203158
[1-(aminomethyl)cyclobutyl]-(3-fluoro-4-methoxyphenyl)methanamine
CID 116943800
[1-(aminomethyl)cyclobutyl]-(3-chloro-4-fluorophenyl)methanamine
CID 116943859
1-[hydroxy-(4-propylphenyl)methyl]cycloheptan-1-ol
CID 103452040
[1-(4-propylphenyl)cyclohexyl]methanamine
CID 82495619

Frequently Asked Questions

What is the IUPAC name of [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine?
The IUPAC name of [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine (CID 116943807) is [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine.
What is the SMILES notation for [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine?
The canonical SMILES for [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine is CCCc1ccc(C(N)C2(CN)CCC2)cc1.
What is the InChIKey of [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine?
The InChIKey is KEWTUROUBRFBTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2/c1-2-4-12-5-7-13(8-6-12)14(17)15(11-16)9-3-10-15/h5-8,14H,2-4,9-11,16-17H2,1H3.
What are the key properties of [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine?
[1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine has a molecular weight of 232.37 g/mol, XLogP of 2.77, 5 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(aminomethyl)cyclobutyl]-(4-propylphenyl)methanamine is sourced from PubChem (CID 116943807), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).