2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine

C12H28N2O2 — CID 103226108

IUPAC2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine
SMILESCCN(CCOC)C(CNC(C)C)COC
InChIInChI=1S/C12H28N2O2/c1-6-14(7-8-15-4)12(10-16-5)9-13-11(2)3/h11-13H,6-10H2,1-5H3
InChIKeyNZSQIPPUORYFDI-UHFFFAOYSA-N
MW232.37 g/mol
LogP0.97
Rot. Bonds10

About 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine

2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine (PubChem CID 103226108) has the molecular formula C12H28N2O2 and a molecular weight of 232.37 g/mol. Its IUPAC name is 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine.

Molecular Properties

Compound Name2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine
PubChem CID103226108
Molecular FormulaC12H28N2O2
Molecular Weight232.37 g/mol
Exact Mass232.22
IUPAC Name2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine
SMILESCCN(CCOC)C(CNC(C)C)COC
InChIInChI=1S/C12H28N2O2/c1-6-14(7-8-15-4)12(10-16-5)9-13-11(2)3/h11-13H,6-10H2,1-5H3
InChIKeyNZSQIPPUORYFDI-UHFFFAOYSA-N
XLogP0.97
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500232.37
LogP ≤ 50.97
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

2-N-(2-methoxyethyl)-2-N-pentan-3-yl-1-N-propan-2-ylbutane-1,2-diamine
CID 55072255
2-N-ethyl-1-N-propan-2-yl-2-N-propylbutane-1,2-diamine
CID 62420464
N-ethyl-N-(1-methoxypropan-2-yl)-2-methyl-N'-propan-2-ylpropane-1,3-diamine
CID 62427389
3-methoxy-2-N,2-N-bis(2-methoxyethyl)-1-N-(2-methylpropyl)propane-1,2-diamine
CID 103226257
2-N,2-N-diethyl-1-N-propan-2-ylbutane-1,2-diamine
CID 62439025
N-(1,3-dimethoxypropan-2-yl)-N-ethyl-3-methylbutan-1-amine
CID 142902659
2-N,2-N-diethyl-1-N-propan-2-ylpropane-1,2-diamine
CID 62438662
2-N-(2-methoxyethyl)-2-N,3-dimethyl-1-N-propan-2-ylbutane-1,2-diamine
CID 62449333
2-N-butan-2-yl-2-N-(2-methoxyethyl)-3-methyl-1-N-propan-2-ylbutane-1,2-diamine
CID 62462781
N'-(2-methoxyethyl)-N,N'-di(propan-2-yl)ethane-1,2-diamine
CID 82949090
2-N-(4,4-dimethylcyclohexyl)-3-methoxy-2-N-methyl-1-N-propan-2-ylpropane-1,2-diamine
CID 103226992
2-N-ethyl-3-methyl-1-N-propan-2-yl-2-N-propylbutane-1,2-diamine
CID 62422151

Frequently Asked Questions

What is the IUPAC name of 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine?
The IUPAC name of 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine (CID 103226108) is 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine.
What is the SMILES notation for 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine?
The canonical SMILES for 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine is CCN(CCOC)C(CNC(C)C)COC.
What is the InChIKey of 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine?
The InChIKey is NZSQIPPUORYFDI-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H28N2O2/c1-6-14(7-8-15-4)12(10-16-5)9-13-11(2)3/h11-13H,6-10H2,1-5H3.
What are the key properties of 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine?
2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine has a molecular weight of 232.37 g/mol, XLogP of 0.97, 10 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-N-ethyl-3-methoxy-2-N-(2-methoxyethyl)-1-N-propan-2-ylpropane-1,2-diamine is sourced from PubChem (CID 103226108), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).