5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine

C11H26N2O3 — CID 103389661

IUPAC5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine
SMILESCOCCOCCNC(CCCN)COC
InChIInChI=1S/C11H26N2O3/c1-14-8-9-16-7-6-13-11(10-15-2)4-3-5-12/h11,13H,3-10,12H2,1-2H3
InChIKeyRQIVVJSJRSURDC-UHFFFAOYSA-N
MW234.34 g/mol
LogP-0.01
Rot. Bonds12

About 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine

5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine (PubChem CID 103389661) has the molecular formula C11H26N2O3 and a molecular weight of 234.34 g/mol. Its IUPAC name is 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine.

Molecular Properties

Compound Name5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine
PubChem CID103389661
Molecular FormulaC11H26N2O3
Molecular Weight234.34 g/mol
Exact Mass234.19
IUPAC Name5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine
SMILESCOCCOCCNC(CCCN)COC
InChIInChI=1S/C11H26N2O3/c1-14-8-9-16-7-6-13-11(10-15-2)4-3-5-12/h11,13H,3-10,12H2,1-2H3
InChIKeyRQIVVJSJRSURDC-UHFFFAOYSA-N
XLogP-0.01
TPSA65.74 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds12
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.34
LogP ≤ 5-0.01
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

5-methoxy-4-N-[4-(2-methoxyethoxy)butyl]pentane-1,4-diamine
CID 103390928
1-methoxy-N-[2-(2-methoxyethoxy)ethyl]hexan-2-amine
CID 115712453
4-chloro-1-methoxy-N-[2-(2-methoxyethoxy)ethyl]butan-2-amine
CID 106152336
4-N-(3-ethenoxypropyl)-5-methoxypentane-1,4-diamine
CID 103387634
2-[(5-amino-1-methoxypentan-2-yl)amino]-N-(2-methoxyethyl)acetamide
CID 103390835
2-[2-(1-methoxyhexan-2-ylamino)ethoxy]ethanol
CID 115707263
tert-butyl N-[2-[(5-amino-1-methoxypentan-2-yl)amino]ethyl]carbamate
CID 107241392
5-methoxy-4-N-(3-phenylbutyl)pentane-1,4-diamine
CID 103389871
3-[(5-amino-1-methoxypentan-2-yl)amino]propane-1,2-diol
CID 103390268
tert-butyl N-[2-[(5-amino-1-methoxypentan-2-yl)amino]ethyl]-N-methylcarbamate
CID 107245084
4-N-(cyclohexylmethyl)-5-methoxypentane-1,4-diamine
CID 103387807
4-N-[2-(dimethylamino)-2-methylpropyl]-5-methoxypentane-1,4-diamine
CID 103387429

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine?
The IUPAC name of 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine (CID 103389661) is 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine.
What is the SMILES notation for 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine?
The canonical SMILES for 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine is COCCOCCNC(CCCN)COC.
What is the InChIKey of 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine?
The InChIKey is RQIVVJSJRSURDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H26N2O3/c1-14-8-9-16-7-6-13-11(10-15-2)4-3-5-12/h11,13H,3-10,12H2,1-2H3.
What are the key properties of 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine?
5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine has a molecular weight of 234.34 g/mol, XLogP of -0.01, 12 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-4-N-[2-(2-methoxyethoxy)ethyl]pentane-1,4-diamine is sourced from PubChem (CID 103389661), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).