N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine

C16H31NO2 — CID 103412730

IUPACN-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
SMILESCOCCOCCCC(CNC1CC1)C1CCCC1
InChIInChI=1S/C16H31NO2/c1-18-11-12-19-10-4-7-15(13-17-16-8-9-16)14-5-2-3-6-14/h14-17H,2-13H2,1H3
InChIKeyIXBOFSFIJJTDAJ-UHFFFAOYSA-N
MW269.43 g/mol
LogP2.99
Rot. Bonds11

About N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine

N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine (PubChem CID 103412730) has the molecular formula C16H31NO2 and a molecular weight of 269.43 g/mol. Its IUPAC name is N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine.

Molecular Properties

Compound NameN-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
PubChem CID103412730
Molecular FormulaC16H31NO2
Molecular Weight269.43 g/mol
Exact Mass269.24
IUPAC NameN-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
SMILESCOCCOCCCC(CNC1CC1)C1CCCC1
InChIInChI=1S/C16H31NO2/c1-18-11-12-19-10-4-7-15(13-17-16-8-9-16)14-5-2-3-6-14/h14-17H,2-13H2,1H3
InChIKeyIXBOFSFIJJTDAJ-UHFFFAOYSA-N
XLogP2.99
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds11
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500269.43
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

2-cyclopentyl-5-(2-methoxyethoxy)-N-(2-methylpropyl)pentan-1-amine
CID 103412733
2-cyclopentyl-4-[2-(2-methoxyethoxy)ethoxy]-N-propan-2-ylbutan-1-amine
CID 104566896
N-[2-[3-(2-methoxyethoxy)propyl]-4-methylpentyl]cyclopropanamine
CID 103412314
N-(2-cyclopentyl-4-ethoxybutyl)cyclopropanamine
CID 112570082
N-[3-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-2-methylpropyl]cyclopropanamine
CID 103075099
1-cyclopropyl-4-[2-(2-methoxyethoxy)ethoxy]-N-methylbutan-1-amine
CID 104564643
N-[2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethyl]cyclopropanamine
CID 104560665
N-[2-benzyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine
CID 103412311
N-[2-[2-(2-methoxyethoxy)ethoxy]-3-methylbutyl]cyclopropanamine
CID 113427443
1-cycloheptyl-3-(2-methoxyethoxy)-N-methylpropan-1-amine
CID 102928168
[1-chloro-5-(2-methoxyethoxy)pentyl]cyclopentane
CID 103411923
2-cyclopentyl-5-ethoxy-N-methylpentan-1-amine
CID 112569754

Frequently Asked Questions

What is the IUPAC name of N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine?
The IUPAC name of N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine (CID 103412730) is N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine.
What is the SMILES notation for N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine?
The canonical SMILES for N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine is COCCOCCCC(CNC1CC1)C1CCCC1.
What is the InChIKey of N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine?
The InChIKey is IXBOFSFIJJTDAJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H31NO2/c1-18-11-12-19-10-4-7-15(13-17-16-8-9-16)14-5-2-3-6-14/h14-17H,2-13H2,1H3.
What are the key properties of N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine?
N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine has a molecular weight of 269.43 g/mol, XLogP of 2.99, 11 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-cyclopentyl-5-(2-methoxyethoxy)pentyl]cyclopropanamine is sourced from PubChem (CID 103412730), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).