N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine

C10H24N2O2 — CID 22075508

IUPACN,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine
SMILESCOCCNCC(C)CNCCOC
InChIInChI=1S/C10H24N2O2/c1-10(8-11-4-6-13-2)9-12-5-7-14-3/h10-12H,4-9H2,1-3H3
InChIKeyZIZFSBBBXAVOHN-UHFFFAOYSA-N
MW204.31 g/mol
LogP0.09
Rot. Bonds10

About N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine

N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine (PubChem CID 22075508) has the molecular formula C10H24N2O2 and a molecular weight of 204.31 g/mol. Its IUPAC name is N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine
PubChem CID22075508
Molecular FormulaC10H24N2O2
Molecular Weight204.31 g/mol
Exact Mass204.18
IUPAC NameN,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine
SMILESCOCCNCC(C)CNCCOC
InChIInChI=1S/C10H24N2O2/c1-10(8-11-4-6-13-2)9-12-5-7-14-3/h10-12H,4-9H2,1-3H3
InChIKeyZIZFSBBBXAVOHN-UHFFFAOYSA-N
XLogP0.09
TPSA42.52 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds10
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500204.31
LogP ≤ 50.09
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine?
The IUPAC name of N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine (CID 22075508) is N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine.
What is the SMILES notation for N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine?
The canonical SMILES for N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine is COCCNCC(C)CNCCOC.
What is the InChIKey of N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine?
The InChIKey is ZIZFSBBBXAVOHN-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H24N2O2/c1-10(8-11-4-6-13-2)9-12-5-7-14-3/h10-12H,4-9H2,1-3H3.
What are the key properties of N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine?
N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine has a molecular weight of 204.31 g/mol, XLogP of 0.09, 10 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N'-bis(2-methoxyethyl)-2-methylpropane-1,3-diamine is sourced from PubChem (CID 22075508), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).