N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine

C16H32N2O — CID 178121516

IUPACN-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine
SMILESCN(CCOCCN(C)C1CCCC1)C1CCCC1
InChIInChI=1S/C16H32N2O/c1-17(15-7-3-4-8-15)11-13-19-14-12-18(2)16-9-5-6-10-16/h15-16H,3-14H2,1-2H3
InChIKeyWXUWBPVUJYXRBH-UHFFFAOYSA-N
MW268.44 g/mol
LogP2.75
Rot. Bonds8

About N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine

N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine (PubChem CID 178121516) has the molecular formula C16H32N2O and a molecular weight of 268.44 g/mol. Its IUPAC name is N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine.

Molecular Properties

Compound NameN-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine
PubChem CID178121516
Molecular FormulaC16H32N2O
Molecular Weight268.44 g/mol
Exact Mass268.25
IUPAC NameN-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine
SMILESCN(CCOCCN(C)C1CCCC1)C1CCCC1
InChIInChI=1S/C16H32N2O/c1-17(15-7-3-4-8-15)11-13-19-14-12-18(2)16-9-5-6-10-16/h15-16H,3-14H2,1-2H3
InChIKeyWXUWBPVUJYXRBH-UHFFFAOYSA-N
XLogP2.75
TPSA15.71 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500268.44
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

ethane;N-(2-ethoxyethyl)-N-methylcyclobutanamine
CID 176920815
N-methyl-N-[2-[2-(propan-2-ylamino)ethoxy]ethyl]cyclopropanamine
CID 102740741
2-[2-[azepan-4-yl(methyl)amino]ethoxy]ethanol
CID 107173264
N'-cyclohexyl-N-[2-[cyclohexyl(methyl)amino]ethyl]-N,N'-dimethylethane-1,2-diamine
CID 178121519
N-methyl-N-[2-[2-(propylamino)ethoxy]ethyl]cyclopropanamine
CID 102740758
N-[2-(3-amino-2,2-dimethylpropoxy)ethyl]-N-methylcyclopropanamine
CID 102741076
N-[2-[2-(2-butoxyethoxy)ethoxy]ethyl]-N-methylpiperidin-4-amine
CID 104565100
4-[methyl(2-propoxyethyl)amino]cyclohexan-1-one
CID 106452882
2-[2-[cyclopropyl(methyl)amino]ethoxy]acetic acid
CID 143874023
4-[2-(2-methoxyethoxy)ethyl-methylamino]cyclohexan-1-one
CID 79120597
N-methyl-N-[2-(3-methylazetidin-3-yl)oxyethyl]cyclobutanamine
CID 102657060
2-[cyclohexyl(methyl)amino]ethanol;hydrochloride
CID 69010720

Frequently Asked Questions

What is the IUPAC name of N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine?
The IUPAC name of N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine (CID 178121516) is N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine.
What is the SMILES notation for N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine?
The canonical SMILES for N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine is CN(CCOCCN(C)C1CCCC1)C1CCCC1.
What is the InChIKey of N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine?
The InChIKey is WXUWBPVUJYXRBH-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H32N2O/c1-17(15-7-3-4-8-15)11-13-19-14-12-18(2)16-9-5-6-10-16/h15-16H,3-14H2,1-2H3.
What are the key properties of N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine?
N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine has a molecular weight of 268.44 g/mol, XLogP of 2.75, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-[2-[cyclopentyl(methyl)amino]ethoxy]ethyl]-N-methylcyclopentanamine is sourced from PubChem (CID 178121516), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).