N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine

C13H30N2O2 — CID 62462305

IUPACN,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCOCCN(CCOC)CC(C)CNC(C)C
InChIInChI=1S/C13H30N2O2/c1-12(2)14-10-13(3)11-15(6-8-16-4)7-9-17-5/h12-14H,6-11H2,1-5H3
InChIKeyHRJWWBKRXWLPJG-UHFFFAOYSA-N
MW246.39 g/mol
LogP1.22
Rot. Bonds11

About N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine

N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine (PubChem CID 62462305) has the molecular formula C13H30N2O2 and a molecular weight of 246.39 g/mol. Its IUPAC name is N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine
PubChem CID62462305
Molecular FormulaC13H30N2O2
Molecular Weight246.39 g/mol
Exact Mass246.23
IUPAC NameN,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine
SMILESCOCCN(CCOC)CC(C)CNC(C)C
InChIInChI=1S/C13H30N2O2/c1-12(2)14-10-13(3)11-15(6-8-16-4)7-9-17-5/h12-14H,6-11H2,1-5H3
InChIKeyHRJWWBKRXWLPJG-UHFFFAOYSA-N
XLogP1.22
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.39
LogP ≤ 51.22
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine?
The IUPAC name of N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine (CID 62462305) is N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine.
What is the SMILES notation for N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine?
The canonical SMILES for N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine is COCCN(CCOC)CC(C)CNC(C)C.
What is the InChIKey of N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine?
The InChIKey is HRJWWBKRXWLPJG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H30N2O2/c1-12(2)14-10-13(3)11-15(6-8-16-4)7-9-17-5/h12-14H,6-11H2,1-5H3.
What are the key properties of N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine?
N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine has a molecular weight of 246.39 g/mol, XLogP of 1.22, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-methoxyethyl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine is sourced from PubChem (CID 62462305), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).