N-[cyclopenten-1-yl(phenyl)methyl]ethanamine

C14H19N — CID 62077860

IUPACN-[cyclopenten-1-yl(phenyl)methyl]ethanamine
SMILESCCNC(C1=CCCC1)c1ccccc1
InChIInChI=1S/C14H19N/c1-2-15-14(13-10-6-7-11-13)12-8-4-3-5-9-12/h3-5,8-10,14-15H,2,6-7,11H2,1H3
InChIKeyUKNOTMDHHNJYMR-UHFFFAOYSA-N
MW201.31 g/mol
LogP3.45
Rot. Bonds4

About N-[cyclopenten-1-yl(phenyl)methyl]ethanamine

N-[cyclopenten-1-yl(phenyl)methyl]ethanamine (PubChem CID 62077860) has the molecular formula C14H19N and a molecular weight of 201.31 g/mol. Its IUPAC name is N-[cyclopenten-1-yl(phenyl)methyl]ethanamine.

Molecular Properties

Compound NameN-[cyclopenten-1-yl(phenyl)methyl]ethanamine
PubChem CID62077860
Molecular FormulaC14H19N
Molecular Weight201.31 g/mol
Exact Mass201.15
IUPAC NameN-[cyclopenten-1-yl(phenyl)methyl]ethanamine
SMILESCCNC(C1=CCCC1)c1ccccc1
InChIInChI=1S/C14H19N/c1-2-15-14(13-10-6-7-11-13)12-8-4-3-5-9-12/h3-5,8-10,14-15H,2,6-7,11H2,1H3
InChIKeyUKNOTMDHHNJYMR-UHFFFAOYSA-N
XLogP3.45
TPSA12.03 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds4
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500201.31
LogP ≤ 53.45
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

N-[[(1E)-cycloocten-1-yl]-(4-fluorophenyl)methyl]ethanamine
CID 106652433
N-[cyclopenten-1-yl-(2-iodophenyl)methyl]ethanamine
CID 62078356
N-[cyclohexen-1-yl-[4-(trifluoromethyl)phenyl]methyl]ethanamine
CID 63505798
N-[cyclohexen-1-yl-(2-methylphenyl)methyl]ethanamine
CID 55034558
N-[(3-bromo-4-methylphenyl)-(cyclopenten-1-yl)methyl]ethanamine
CID 81471848
N-[[(1E)-cycloocten-1-yl]-(3-methoxyphenyl)methyl]ethanamine
CID 106652417
N-benzhydrylethanamine;ethane
CID 142974710
N-[(3-bromo-5-chlorophenyl)-(cyclopenten-1-yl)methyl]ethanamine
CID 107950541
N-[(3-chloro-4-iodophenyl)-[(1E)-cycloocten-1-yl]methyl]ethanamine
CID 106656144
N-[cyclohepten-1-yl-(2-methylsulfanylphenyl)methyl]ethanamine
CID 103718540
N-[(4-bromo-3-methylphenyl)-(cyclohexen-1-yl)methyl]ethanamine
CID 113396706
N-[(3-bromo-4-methylphenyl)-(cyclohexen-1-yl)methyl]ethanamine
CID 81471701

Frequently Asked Questions

What is the IUPAC name of N-[cyclopenten-1-yl(phenyl)methyl]ethanamine?
The IUPAC name of N-[cyclopenten-1-yl(phenyl)methyl]ethanamine (CID 62077860) is N-[cyclopenten-1-yl(phenyl)methyl]ethanamine.
What is the SMILES notation for N-[cyclopenten-1-yl(phenyl)methyl]ethanamine?
The canonical SMILES for N-[cyclopenten-1-yl(phenyl)methyl]ethanamine is CCNC(C1=CCCC1)c1ccccc1.
What is the InChIKey of N-[cyclopenten-1-yl(phenyl)methyl]ethanamine?
The InChIKey is UKNOTMDHHNJYMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N/c1-2-15-14(13-10-6-7-11-13)12-8-4-3-5-9-12/h3-5,8-10,14-15H,2,6-7,11H2,1H3.
What are the key properties of N-[cyclopenten-1-yl(phenyl)methyl]ethanamine?
N-[cyclopenten-1-yl(phenyl)methyl]ethanamine has a molecular weight of 201.31 g/mol, XLogP of 3.45, 4 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for N-[cyclopenten-1-yl(phenyl)methyl]ethanamine is sourced from PubChem (CID 62077860), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).