N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine

C15H24N2O — CID 43266852

IUPACN-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine
SMILESCN(CCOc1ccc(CN)cc1)C1CCCC1
InChIInChI=1S/C15H24N2O/c1-17(14-4-2-3-5-14)10-11-18-15-8-6-13(12-16)7-9-15/h6-9,14H,2-5,10-12,16H2,1H3
InChIKeyTUZWFTFOFYNGME-UHFFFAOYSA-N
MW248.37 g/mol
LogP2.40
Rot. Bonds6

About N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine

N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine (PubChem CID 43266852) has the molecular formula C15H24N2O and a molecular weight of 248.37 g/mol. Its IUPAC name is N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine
PubChem CID43266852
Molecular FormulaC15H24N2O
Molecular Weight248.37 g/mol
Exact Mass248.19
IUPAC NameN-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine
SMILESCN(CCOc1ccc(CN)cc1)C1CCCC1
InChIInChI=1S/C15H24N2O/c1-17(14-4-2-3-5-14)10-11-18-15-8-6-13(12-16)7-9-15/h6-9,14H,2-5,10-12,16H2,1H3
InChIKeyTUZWFTFOFYNGME-UHFFFAOYSA-N
XLogP2.40
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500248.37
LogP ≤ 52.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopropanamine
CID 43264634
N-[2-[4-(2-aminoethyl)phenoxy]ethyl]-N-methylcyclopentanamine
CID 43266888
N-[2-(4-aminophenoxy)ethyl]-N-methylcyclooctanamine
CID 89350544
2-[4-[2-[cyclopentyl(methyl)amino]ethoxy]phenyl]ethanethioamide
CID 43290625
2-[4-[2-[cyclohexyl(methyl)amino]ethoxy]phenyl]acetonitrile
CID 43288697
N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methyl-1,1-dioxothiolan-3-amine
CID 43648583
N-[2-(4-bromophenoxy)ethyl]-N-methylcyclobutanamine
CID 115666053
4-[2-[cyclopentyl(methyl)amino]ethoxy]-N'-hydroxybenzenecarboximidamide
CID 61299834
N-[2-[4-(2-aminoethyl)phenoxy]ethyl]-N,1-dimethylpiperidin-4-amine
CID 43253521
3-[2-[4-(aminomethyl)phenoxy]ethyl-cyclobutylamino]propan-1-ol
CID 102860586
N-[3-(4-bromophenoxy)propyl]-N-methylcyclohexanamine
CID 5262176
N-[3-[4-(aminomethyl)phenoxy]propyl]-N-propylcyclopropanamine
CID 43270088

Frequently Asked Questions

What is the IUPAC name of N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine?
The IUPAC name of N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine (CID 43266852) is N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine is CN(CCOc1ccc(CN)cc1)C1CCCC1.
What is the InChIKey of N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine?
The InChIKey is TUZWFTFOFYNGME-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H24N2O/c1-17(14-4-2-3-5-14)10-11-18-15-8-6-13(12-16)7-9-15/h6-9,14H,2-5,10-12,16H2,1H3.
What are the key properties of N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine?
N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine has a molecular weight of 248.37 g/mol, XLogP of 2.40, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[4-(aminomethyl)phenoxy]ethyl]-N-methylcyclopentanamine is sourced from PubChem (CID 43266852), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).