1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine

C13H29NO5 — CID 91737176

IUPAC1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine
SMILESCOCCN(CCOC)C(COC)(COC)COC
InChIInChI=1S/C13H29NO5/c1-15-8-6-14(7-9-16-2)13(10-17-3,11-18-4)12-19-5/h6-12H2,1-5H3
InChIKeyOKACOZYDHFXGAS-UHFFFAOYSA-N
MW279.38 g/mol
LogP0.26
Rot. Bonds13

About 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine

1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine (PubChem CID 91737176) has the molecular formula C13H29NO5 and a molecular weight of 279.38 g/mol. Its IUPAC name is 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine.

Molecular Properties

Compound Name1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine
PubChem CID91737176
Molecular FormulaC13H29NO5
Molecular Weight279.38 g/mol
Exact Mass279.20
IUPAC Name1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine
SMILESCOCCN(CCOC)C(COC)(COC)COC
InChIInChI=1S/C13H29NO5/c1-15-8-6-14(7-9-16-2)13(10-17-3,11-18-4)12-19-5/h6-12H2,1-5H3
InChIKeyOKACOZYDHFXGAS-UHFFFAOYSA-N
XLogP0.26
TPSA49.39 Ų
H-Bond Donors
H-Bond Acceptors6
Rotatable Bonds13
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500279.38
LogP ≤ 50.26
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 106

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Frequently Asked Questions

What is the IUPAC name of 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine?
The IUPAC name of 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine (CID 91737176) is 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine.
What is the SMILES notation for 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine?
The canonical SMILES for 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine is COCCN(CCOC)C(COC)(COC)COC.
What is the InChIKey of 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine?
The InChIKey is OKACOZYDHFXGAS-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H29NO5/c1-15-8-6-14(7-9-16-2)13(10-17-3,11-18-4)12-19-5/h6-12H2,1-5H3.
What are the key properties of 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine?
1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine has a molecular weight of 279.38 g/mol, XLogP of 0.26, 13 rotatable bonds, 0 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for 1,3-dimethoxy-N,N-bis(2-methoxyethyl)-2-(methoxymethyl)propan-2-amine is sourced from PubChem (CID 91737176), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).