N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine

C8H20N2O2 — CID 66224074

IUPACN'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)CC(OC)OC
InChIInChI=1S/C8H20N2O2/c1-9-5-6-10(2)7-8(11-3)12-4/h8-9H,5-7H2,1-4H3
InChIKeyJWLDAAMTXAHVNP-UHFFFAOYSA-N
MW176.26 g/mol
LogP-0.24
Rot. Bonds7

About N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine

N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine (PubChem CID 66224074) has the molecular formula C8H20N2O2 and a molecular weight of 176.26 g/mol. Its IUPAC name is N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine.

Molecular Properties

Compound NameN'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine
PubChem CID66224074
Molecular FormulaC8H20N2O2
Molecular Weight176.26 g/mol
Exact Mass176.15
IUPAC NameN'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine
SMILESCNCCN(C)CC(OC)OC
InChIInChI=1S/C8H20N2O2/c1-9-5-6-10(2)7-8(11-3)12-4/h8-9H,5-7H2,1-4H3
InChIKeyJWLDAAMTXAHVNP-UHFFFAOYSA-N
XLogP-0.24
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500176.26
LogP ≤ 5-0.24
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine?
The IUPAC name of N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine (CID 66224074) is N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine.
What is the SMILES notation for N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine?
The canonical SMILES for N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine is CNCCN(C)CC(OC)OC.
What is the InChIKey of N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine?
The InChIKey is JWLDAAMTXAHVNP-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H20N2O2/c1-9-5-6-10(2)7-8(11-3)12-4/h8-9H,5-7H2,1-4H3.
What are the key properties of N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine?
N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine has a molecular weight of 176.26 g/mol, XLogP of -0.24, 7 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,2-dimethoxyethyl)-N,N'-dimethylethane-1,2-diamine is sourced from PubChem (CID 66224074), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).