1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine

C15H21N — CID 62079794

IUPAC1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)C2=CCCC2)cc1
InChIInChI=1S/C15H21N/c1-3-12-8-10-14(11-9-12)15(16-2)13-6-4-5-7-13/h6,8-11,15-16H,3-5,7H2,1-2H3
InChIKeyAIILMLHPJYHGRS-UHFFFAOYSA-N
MW215.34 g/mol
LogP3.62
Rot. Bonds4

About 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine

1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine (PubChem CID 62079794) has the molecular formula C15H21N and a molecular weight of 215.34 g/mol. Its IUPAC name is 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine.

Molecular Properties

Compound Name1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine
PubChem CID62079794
Molecular FormulaC15H21N
Molecular Weight215.34 g/mol
Exact Mass215.17
IUPAC Name1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine
SMILESCCc1ccc(C(NC)C2=CCCC2)cc1
InChIInChI=1S/C15H21N/c1-3-12-8-10-14(11-9-12)15(16-2)13-6-4-5-7-13/h6,8-11,15-16H,3-5,7H2,1-2H3
InChIKeyAIILMLHPJYHGRS-UHFFFAOYSA-N
XLogP3.62
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.34
LogP ≤ 53.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

[cyclohepten-1-yl-(4-ethylphenyl)methyl]hydrazine
CID 106648595
1-[(1E)-cycloocten-1-yl]-N-methyl-1-(4-methylphenyl)methanamine
CID 106652492
1-(cyclohepten-1-yl)-N-methyl-1-pyridin-4-ylmethanamine
CID 82237298
1-(cyclohexen-1-yl)-N-methyl-1-(4-methylsulfonylphenyl)methanamine
CID 55034413
1-(cyclohexen-1-yl)-1-[4-(difluoromethoxy)phenyl]-N-methylmethanamine
CID 62080331
[(1E)-cycloocten-1-yl]-(4-ethylphenyl)methanamine
CID 106652462
1-(cyclopenten-1-yl)-N-methyl-1-naphthalen-2-ylmethanamine
CID 62077852
1-(4-chloro-3-fluorophenyl)-1-(cyclohepten-1-yl)-N-methylmethanamine
CID 107995961
1-(3-chloro-4-fluorophenyl)-1-[(1E)-cycloocten-1-yl]-N-methylmethanamine
CID 106652930
1-(cyclohexen-1-yl)-N-methyl-1-(3,4,5-trifluorophenyl)methanamine
CID 55160436
1-(cyclopenten-1-yl)-1-(3-ethylthiophen-2-yl)-N-methylmethanamine
CID 79985467
N-[cyclopenten-1-yl(phenyl)methyl]ethanamine
CID 62077860

Frequently Asked Questions

What is the IUPAC name of 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine?
The IUPAC name of 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine (CID 62079794) is 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine.
What is the SMILES notation for 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine?
The canonical SMILES for 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine is CCc1ccc(C(NC)C2=CCCC2)cc1.
What is the InChIKey of 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine?
The InChIKey is AIILMLHPJYHGRS-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H21N/c1-3-12-8-10-14(11-9-12)15(16-2)13-6-4-5-7-13/h6,8-11,15-16H,3-5,7H2,1-2H3.
What are the key properties of 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine?
1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine has a molecular weight of 215.34 g/mol, XLogP of 3.62, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(cyclopenten-1-yl)-1-(4-ethylphenyl)-N-methylmethanamine is sourced from PubChem (CID 62079794), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).