N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine

C10H22N2O — CID 103339375

IUPACN'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
SMILESC=CCN(CCOC)CC(C)CN
InChIInChI=1S/C10H22N2O/c1-4-5-12(6-7-13-3)9-10(2)8-11/h4,10H,1,5-9,11H2,2-3H3
InChIKeyKDALVENRGSRMLM-UHFFFAOYSA-N
MW186.30 g/mol
LogP0.72
Rot. Bonds8

About N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine

N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine (PubChem CID 103339375) has the molecular formula C10H22N2O and a molecular weight of 186.30 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
PubChem CID103339375
Molecular FormulaC10H22N2O
Molecular Weight186.30 g/mol
Exact Mass186.17
IUPAC NameN'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
SMILESC=CCN(CCOC)CC(C)CN
InChIInChI=1S/C10H22N2O/c1-4-5-12(6-7-13-3)9-10(2)8-11/h4,10H,1,5-9,11H2,2-3H3
InChIKeyKDALVENRGSRMLM-UHFFFAOYSA-N
XLogP0.72
TPSA38.49 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500186.30
LogP ≤ 50.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

1-N-(2-methoxyethyl)-1-N-prop-2-enylpropane-1,2-diamine
CID 103339269
N-ethyl-N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
CID 103339273
N'-(2-methoxyethyl)-N'-prop-2-enylpropane-1,3-diamine
CID 103339366
2-[2-methoxyethyl(prop-2-enyl)amino]ethanol
CID 115613713
1-N-(2-methoxyethyl)-3-phenyl-1-N-prop-2-enylpropane-1,2-diamine
CID 103339332
N'-(2-methoxyethyl)-2-methyl-N'-(2-methylpropyl)butane-1,4-diamine
CID 81079086
N',N'-bis(2-methoxyethyl)-2-methylpentane-1,5-diamine
CID 82683899
N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine
CID 103339315
N'-(2-methylpropyl)-N'-prop-2-enylethane-1,2-diamine
CID 62381780
N'-(2-methoxyethyl)-3,3-dimethyl-N'-prop-2-enylhexane-1,6-diamine
CID 103339345
N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
CID 103339442
1-[[2-methoxyethyl(prop-2-enyl)amino]methyl]cyclopentan-1-amine
CID 103339270

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine?
The IUPAC name of N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine (CID 103339375) is N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine.
What is the SMILES notation for N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine?
The canonical SMILES for N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine is C=CCN(CCOC)CC(C)CN.
What is the InChIKey of N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine?
The InChIKey is KDALVENRGSRMLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H22N2O/c1-4-5-12(6-7-13-3)9-10(2)8-11/h4,10H,1,5-9,11H2,2-3H3.
What are the key properties of N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine?
N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine has a molecular weight of 186.30 g/mol, XLogP of 0.72, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine is sourced from PubChem (CID 103339375), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).