N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine

C13H28N2O3 — CID 113461867

IUPACN-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine
SMILESCOCCOCCCNC(C)CC1COCCN1
InChIInChI=1S/C13H28N2O3/c1-12(10-13-11-18-7-5-15-13)14-4-3-6-17-9-8-16-2/h12-15H,3-11H2,1-2H3
InChIKeyGAIUGBGAGRVOMV-UHFFFAOYSA-N
MW260.38 g/mol
LogP0.40
Rot. Bonds10

About N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine

N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine (PubChem CID 113461867) has the molecular formula C13H28N2O3 and a molecular weight of 260.38 g/mol. Its IUPAC name is N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine.

Molecular Properties

Compound NameN-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine
PubChem CID113461867
Molecular FormulaC13H28N2O3
Molecular Weight260.38 g/mol
Exact Mass260.21
IUPAC NameN-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine
SMILESCOCCOCCCNC(C)CC1COCCN1
InChIInChI=1S/C13H28N2O3/c1-12(10-13-11-18-7-5-15-13)14-4-3-6-17-9-8-16-2/h12-15H,3-11H2,1-2H3
InChIKeyGAIUGBGAGRVOMV-UHFFFAOYSA-N
XLogP0.40
TPSA51.75 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds10
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500260.38
LogP ≤ 50.40
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

N',N'-dimethyl-N-(1-morpholin-3-ylpropan-2-yl)butane-1,4-diamine
CID 113461930
4-methoxy-N-(1-pyrrolidin-2-ylpropan-2-yl)butan-1-amine
CID 79541172
N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]cyclopropanecarboxamide
CID 113481318
N-[1-(azepan-2-yl)propan-2-yl]-4-methoxybutan-1-amine
CID 79560965
N-(3-ethoxypropyl)-1-pyrrolidin-2-ylpropan-2-amine
CID 79541660
3-(2-methoxyethoxy)-N-[1-(oxolan-3-yl)ethyl]propan-1-amine
CID 115707883
4-[(1-morpholin-3-ylpropan-2-ylamino)methyl]cyclohexan-1-ol
CID 106124715
tert-butyl N-[4-(1-morpholin-3-ylpropan-2-ylamino)butan-2-yl]carbamate
CID 107246908
tert-butyl N-methyl-N-[2-(1-morpholin-3-ylpropan-2-ylamino)ethyl]carbamate
CID 107244961
1-morpholin-3-yl-N-(2-thiomorpholin-4-ylethyl)propan-2-amine
CID 114173708
1-(azepan-2-yl)-N-(3-ethenoxypropyl)propan-2-amine
CID 79560276
3-(2-methylpropyl)morpholine
CID 20811826

Frequently Asked Questions

What is the IUPAC name of N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine?
The IUPAC name of N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine (CID 113461867) is N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine.
What is the SMILES notation for N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine?
The canonical SMILES for N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine is COCCOCCCNC(C)CC1COCCN1.
What is the InChIKey of N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine?
The InChIKey is GAIUGBGAGRVOMV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2O3/c1-12(10-13-11-18-7-5-15-13)14-4-3-6-17-9-8-16-2/h12-15H,3-11H2,1-2H3.
What are the key properties of N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine?
N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine has a molecular weight of 260.38 g/mol, XLogP of 0.40, 10 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(2-methoxyethoxy)propyl]-1-morpholin-3-ylpropan-2-amine is sourced from PubChem (CID 113461867), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).