N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine

C9H22N2O2 — CID 89488905

IUPACN'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine
SMILESCOCC(CN(C)CCCN)OC
InChIInChI=1S/C9H22N2O2/c1-11(6-4-5-10)7-9(13-3)8-12-2/h9H,4-8,10H2,1-3H3
InChIKeyHEDBJIWRUWUZIT-UHFFFAOYSA-N
MW190.29 g/mol
LogP-0.07
Rot. Bonds8

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

N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine (PubChem CID 89488905) has the molecular formula C9H22N2O2 and a molecular weight of 190.29 g/mol. Its IUPAC name is N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine
PubChem CID89488905
Molecular FormulaC9H22N2O2
Molecular Weight190.29 g/mol
Exact Mass190.17
IUPAC NameN'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine
SMILESCOCC(CN(C)CCCN)OC
InChIInChI=1S/C9H22N2O2/c1-11(6-4-5-10)7-9(13-3)8-12-2/h9H,4-8,10H2,1-3H3
InChIKeyHEDBJIWRUWUZIT-UHFFFAOYSA-N
XLogP-0.07
TPSA47.72 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500190.29
LogP ≤ 5-0.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine?
The IUPAC name of N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine (CID 89488905) is N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine.
What is the SMILES notation for N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine?
The canonical SMILES for N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine is COCC(CN(C)CCCN)OC.
What is the InChIKey of N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine?
The InChIKey is HEDBJIWRUWUZIT-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H22N2O2/c1-11(6-4-5-10)7-9(13-3)8-12-2/h9H,4-8,10H2,1-3H3.
What are the key properties of N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine?
N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine has a molecular weight of 190.29 g/mol, XLogP of -0.07, 8 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2,3-dimethoxypropyl)-N'-methylpropane-1,3-diamine is sourced from PubChem (CID 89488905), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).