N-[3-(2-methoxyethoxy)propyl]pentan-3-amine

C11H25NO2 — CID 28720947

IUPACN-[3-(2-methoxyethoxy)propyl]pentan-3-amine
SMILESCCC(CC)NCCCOCCOC
InChIInChI=1S/C11H25NO2/c1-4-11(5-2)12-7-6-8-14-10-9-13-3/h11-12H,4-10H2,1-3H3
InChIKeyCNKCPMMSEIGJHZ-UHFFFAOYSA-N
MW203.33 g/mol
LogP1.82
Rot. Bonds10

About N-[3-(2-methoxyethoxy)propyl]pentan-3-amine

N-[3-(2-methoxyethoxy)propyl]pentan-3-amine (PubChem CID 28720947) has the molecular formula C11H25NO2 and a molecular weight of 203.33 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)propyl]pentan-3-amine.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)propyl]pentan-3-amine
PubChem CID28720947
Molecular FormulaC11H25NO2
Molecular Weight203.33 g/mol
Exact Mass203.19
IUPAC NameN-[3-(2-methoxyethoxy)propyl]pentan-3-amine
SMILESCCC(CC)NCCCOCCOC
InChIInChI=1S/C11H25NO2/c1-4-11(5-2)12-7-6-8-14-10-9-13-3/h11-12H,4-10H2,1-3H3
InChIKeyCNKCPMMSEIGJHZ-UHFFFAOYSA-N
XLogP1.82
TPSA30.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.33
LogP ≤ 51.82
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

N-[4-(2-methoxyethoxy)butyl]pentan-3-amine
CID 115715449
N-[3-(2-methylpropoxy)propyl]pentan-3-amine
CID 28681675
N-(2-butoxyethyl)pentan-3-amine
CID 61168899
1-ethoxy-N-[3-(2-methoxyethoxy)propyl]propan-2-amine
CID 115707889
2-ethyl-N-[3-(2-methoxyethoxy)propyl]butan-1-amine
CID 28720680
5-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]-N-propan-2-ylpentan-1-amine
CID 104566618
N-ethyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-amine
CID 104560543
N-[3-(2-methoxyethoxy)propyl]-5-methylhexan-2-amine
CID 43206916
(2R)-2-[3-(2-methoxyethoxy)propylamino]propanoic acid
CID 103410935
methyl 2-[3-(2-methoxyethoxy)propylamino]propanoate
CID 66173501
N-(3-propan-2-yloxypropyl)pentan-3-amine
CID 28727128
5-methoxy-4-N-[4-(2-methoxyethoxy)butyl]pentane-1,4-diamine
CID 103390928

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)propyl]pentan-3-amine?
The IUPAC name of N-[3-(2-methoxyethoxy)propyl]pentan-3-amine (CID 28720947) is N-[3-(2-methoxyethoxy)propyl]pentan-3-amine.
What is the SMILES notation for N-[3-(2-methoxyethoxy)propyl]pentan-3-amine?
The canonical SMILES for N-[3-(2-methoxyethoxy)propyl]pentan-3-amine is CCC(CC)NCCCOCCOC.
What is the InChIKey of N-[3-(2-methoxyethoxy)propyl]pentan-3-amine?
The InChIKey is CNKCPMMSEIGJHZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H25NO2/c1-4-11(5-2)12-7-6-8-14-10-9-13-3/h11-12H,4-10H2,1-3H3.
What are the key properties of N-[3-(2-methoxyethoxy)propyl]pentan-3-amine?
N-[3-(2-methoxyethoxy)propyl]pentan-3-amine has a molecular weight of 203.33 g/mol, XLogP of 1.82, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)propyl]pentan-3-amine is sourced from PubChem (CID 28720947), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).