N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine

C11H24N2O2 — CID 62561595

IUPACN',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine
SMILESC=CCNCCN(CCOC)CCOC
InChIInChI=1S/C11H24N2O2/c1-4-5-12-6-7-13(8-10-14-2)9-11-15-3/h4,12H,1,5-11H2,2-3H3
InChIKeyCQNBJTSVUZTZLZ-UHFFFAOYSA-N
MW216.32 g/mol
LogP0.36
Rot. Bonds11

About N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine

N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine (PubChem CID 62561595) has the molecular formula C11H24N2O2 and a molecular weight of 216.32 g/mol. Its IUPAC name is N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine.

Molecular Properties

Compound NameN',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine
PubChem CID62561595
Molecular FormulaC11H24N2O2
Molecular Weight216.32 g/mol
Exact Mass216.18
IUPAC NameN',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine
SMILESC=CCNCCN(CCOC)CCOC
InChIInChI=1S/C11H24N2O2/c1-4-5-12-6-7-13(8-10-14-2)9-11-15-3/h4,12H,1,5-11H2,2-3H3
InChIKeyCQNBJTSVUZTZLZ-UHFFFAOYSA-N
XLogP0.36
TPSA33.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds11
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.32
LogP ≤ 50.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

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

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Related Compounds

N'-(2-methoxyethyl)-N'-methyl-N-prop-2-enylethane-1,2-diamine
CID 62557035
N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
CID 103339442
N'-(2-methoxyethyl)-N'-(1-methoxypropan-2-yl)-N-prop-2-enylethane-1,2-diamine
CID 62556998
N',N'-bis(2-methoxyethyl)-N-prop-2-ynylethane-1,2-diamine
CID 62560104
N',N'-bis(2-methoxyethyl)-N-(2-methylpropyl)ethane-1,2-diamine
CID 62462476
N-[2-(3-methoxypropoxy)ethyl]prop-2-en-1-amine
CID 62566842
N,N'-diethyl-N'-(2-methoxyethyl)ethane-1,2-diamine
CID 18965073
3-[2-[bis(2-methoxyethyl)amino]ethylamino]propanoic acid
CID 166790089
N-(2-butoxyethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 62559728
N-(cyclohexylmethyl)-N',N'-bis(2-methoxyethyl)ethane-1,2-diamine
CID 62561222
2-N-(2-methoxyethyl)-2-N-propan-2-yl-1-N-prop-2-enylpropane-1,2-diamine
CID 82953229
2-N-butan-2-yl-2-N-(2-methoxyethyl)-1-N-prop-2-enylpropane-1,2-diamine
CID 62569622

Frequently Asked Questions

What is the IUPAC name of N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine?
The IUPAC name of N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine (CID 62561595) is N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine.
What is the SMILES notation for N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine?
The canonical SMILES for N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine is C=CCNCCN(CCOC)CCOC.
What is the InChIKey of N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine?
The InChIKey is CQNBJTSVUZTZLZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O2/c1-4-5-12-6-7-13(8-10-14-2)9-11-15-3/h4,12H,1,5-11H2,2-3H3.
What are the key properties of N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine?
N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine has a molecular weight of 216.32 g/mol, XLogP of 0.36, 11 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N',N'-bis(2-methoxyethyl)-N-prop-2-enylethane-1,2-diamine is sourced from PubChem (CID 62561595), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).