N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine

C13H29NO4 — CID 176738273

IUPACN,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine
SMILESCCN(CC)C(COCCOC)COCCOC
InChIInChI=1S/C13H29NO4/c1-5-14(6-2)13(11-17-9-7-15-3)12-18-10-8-16-4/h13H,5-12H2,1-4H3
InChIKeyHCVVVTZZCANJHS-UHFFFAOYSA-N
MW263.38 g/mol
LogP1.02
Rot. Bonds13

About N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine

N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine (PubChem CID 176738273) has the molecular formula C13H29NO4 and a molecular weight of 263.38 g/mol. Its IUPAC name is N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine.

Molecular Properties

Compound NameN,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine
PubChem CID176738273
Molecular FormulaC13H29NO4
Molecular Weight263.38 g/mol
Exact Mass263.21
IUPAC NameN,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine
SMILESCCN(CC)C(COCCOC)COCCOC
InChIInChI=1S/C13H29NO4/c1-5-14(6-2)13(11-17-9-7-15-3)12-18-10-8-16-4/h13H,5-12H2,1-4H3
InChIKeyHCVVVTZZCANJHS-UHFFFAOYSA-N
XLogP1.02
TPSA40.16 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds13
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.38
LogP ≤ 51.02
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

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Related Compounds

1-ethoxy-3-(2-methoxyethoxy)-N-(2-methoxyethyl)-N-propan-2-ylpropan-2-amine
CID 176738309
1-methoxy-3-(2-methoxyethoxy)-N-(2-methoxyethyl)-N-propan-2-ylpropan-2-amine
CID 176738256
triethyl-[2-[2-(2-methoxyethoxy)ethoxy]ethoxymethyl]phosphanium
CID 149435050
N-(1,3-dimethoxypropan-2-yl)-N-ethyl-3-methylbutan-1-amine
CID 142902659
1-(2-methoxyethoxy)butan-2-ol
CID 20514540
1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 87439194
1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane
CID 8189
1,2-dimethoxyethane;1-methoxy-2-(2-methoxyethoxy)ethane;1-methoxy-2-[2-(2-methoxyethoxy)ethoxy]ethane;1-methoxy-2-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]ethane
CID 159847962
4-N,4-N-diethyl-5-methoxypentane-1,4-diamine
CID 103391611
ethyl 3-(2-methoxyethoxy)-2-methylpropanoate
CID 114997793
N-ethyl-1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-amine
CID 104560543
1-[2-[2-(2-methoxyethoxy)ethoxy]ethoxy]butan-2-ol
CID 104564611

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine?
The IUPAC name of N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine (CID 176738273) is N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine.
What is the SMILES notation for N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine?
The canonical SMILES for N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine is CCN(CC)C(COCCOC)COCCOC.
What is the InChIKey of N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine?
The InChIKey is HCVVVTZZCANJHS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO4/c1-5-14(6-2)13(11-17-9-7-15-3)12-18-10-8-16-4/h13H,5-12H2,1-4H3.
What are the key properties of N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine?
N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine has a molecular weight of 263.38 g/mol, XLogP of 1.02, 13 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-1,3-bis(2-methoxyethoxy)propan-2-amine is sourced from PubChem (CID 176738273), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).