N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine

C14H30N2O3 — CID 104561146

IUPACN'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
SMILESCOCCOCCOCCN(CCN)C1CCCC1
InChIInChI=1S/C14H30N2O3/c1-17-10-11-19-13-12-18-9-8-16(7-6-15)14-4-2-3-5-14/h14H,2-13,15H2,1H3
InChIKeyRCTKXSSOCFVGMK-UHFFFAOYSA-N
MW274.40 g/mol
LogP0.87
Rot. Bonds12

About N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine

N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine (PubChem CID 104561146) has the molecular formula C14H30N2O3 and a molecular weight of 274.40 g/mol. Its IUPAC name is N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine.

Molecular Properties

Compound NameN'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
PubChem CID104561146
Molecular FormulaC14H30N2O3
Molecular Weight274.40 g/mol
Exact Mass274.23
IUPAC NameN'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine
SMILESCOCCOCCOCCN(CCN)C1CCCC1
InChIInChI=1S/C14H30N2O3/c1-17-10-11-19-13-12-18-9-8-16(7-6-15)14-4-2-3-5-14/h14H,2-13,15H2,1H3
InChIKeyRCTKXSSOCFVGMK-UHFFFAOYSA-N
XLogP0.87
TPSA56.95 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500274.40
LogP ≤ 50.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

N'-cyclobutyl-N'-[2-(3-methoxypropoxy)ethyl]ethane-1,2-diamine
CID 103184116
2-[cyclohexyl-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]amino]ethanol
CID 104566071
N-(2-bromoethyl)-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclohexanamine
CID 104567265
N-(2-bromoethyl)-N-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]cyclopropanamine
CID 104567253
N-(2-bromoethyl)-N-[3-(2-methoxyethoxy)propyl]cyclopentanamine
CID 103413097
N-[2-(2-aminoethoxy)ethyl]-N-ethylcyclohexanamine
CID 19098628
N'-cyclohexyl-N'-(2-propan-2-yloxyethyl)ethane-1,2-diamine
CID 63759697
N'-cyclohexyl-N'-[2-[(2-methylpropan-2-yl)oxy]ethyl]ethane-1,2-diamine
CID 112591848
N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]-N'-methylethane-1,2-diamine
CID 104561076
N'-cyclopropyl-N'-[2-(2-methylpropoxy)ethyl]ethane-1,2-diamine
CID 106450873
N'-cyclohexyl-N'-propylethane-1,2-diamine
CID 61348599
2-[2-aminoethyl(cyclobutyl)amino]-N-(2-methoxyethyl)acetamide
CID 102875295

Frequently Asked Questions

What is the IUPAC name of N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine?
The IUPAC name of N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine (CID 104561146) is N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine.
What is the SMILES notation for N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine?
The canonical SMILES for N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine is COCCOCCOCCN(CCN)C1CCCC1.
What is the InChIKey of N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine?
The InChIKey is RCTKXSSOCFVGMK-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H30N2O3/c1-17-10-11-19-13-12-18-9-8-16(7-6-15)14-4-2-3-5-14/h14H,2-13,15H2,1H3.
What are the key properties of N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine?
N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine has a molecular weight of 274.40 g/mol, XLogP of 0.87, 12 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N'-cyclopentyl-N'-[2-[2-(2-methoxyethoxy)ethoxy]ethyl]ethane-1,2-diamine is sourced from PubChem (CID 104561146), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).