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

C12H26N2O — CID 103339315

IUPACN'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine
SMILESC=CCN(CCCNC(C)C)CCOC
InChIInChI=1S/C12H26N2O/c1-5-8-14(10-11-15-4)9-6-7-13-12(2)3/h5,12-13H,1,6-11H2,2-4H3
InChIKeyGTXNANYODRNGSV-UHFFFAOYSA-N
MW214.35 g/mol
LogP1.51
Rot. Bonds10

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

N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine (PubChem CID 103339315) has the molecular formula C12H26N2O and a molecular weight of 214.35 g/mol. Its IUPAC name is N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine.

Molecular Properties

Compound NameN'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine
PubChem CID103339315
Molecular FormulaC12H26N2O
Molecular Weight214.35 g/mol
Exact Mass214.20
IUPAC NameN'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine
SMILESC=CCN(CCCNC(C)C)CCOC
InChIInChI=1S/C12H26N2O/c1-5-8-14(10-11-15-4)9-6-7-13-12(2)3/h5,12-13H,1,6-11H2,2-4H3
InChIKeyGTXNANYODRNGSV-UHFFFAOYSA-N
XLogP1.51
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds10
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500214.35
LogP ≤ 51.51
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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'-prop-2-enylpropane-1,3-diamine
CID 103339366
2-[2-methoxyethyl(prop-2-enyl)amino]ethanol
CID 115613713
N,N'-bis(2-methoxyethyl)-N'-prop-2-enylethane-1,2-diamine
CID 103339442
1-N-(2-methoxyethyl)-1-N-prop-2-enylpropane-1,2-diamine
CID 103339269
N'-(2-methoxyethyl)-3,3-dimethyl-N'-prop-2-enylhexane-1,6-diamine
CID 103339345
N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
CID 103339375
N'-(2-methoxyethyl)-N'-methyl-N-propan-2-ylpentane-1,5-diamine
CID 62448411
N-ethyl-N'-(2-methoxyethyl)-2-methyl-N'-prop-2-enylpropane-1,3-diamine
CID 103339273
N'-(2-methoxyethyl)-N,N'-di(propan-2-yl)ethane-1,2-diamine
CID 82949090
4-N-(2-methoxyethyl)-1-N-methyl-4-N-prop-2-enylpentane-1,4-diamine
CID 103340397
4-N-(2-methoxyethyl)-1-N,4-N-di(propan-2-yl)pentane-1,4-diamine
CID 82952231
N',N'-bis(2-methylpropyl)-N-propan-2-ylpropane-1,3-diamine
CID 59849268

Frequently Asked Questions

What is the IUPAC name of N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine?
The IUPAC name of N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine (CID 103339315) is N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine.
What is the SMILES notation for N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine?
The canonical SMILES for N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine is C=CCN(CCCNC(C)C)CCOC.
What is the InChIKey of N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine?
The InChIKey is GTXNANYODRNGSV-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2O/c1-5-8-14(10-11-15-4)9-6-7-13-12(2)3/h5,12-13H,1,6-11H2,2-4H3.
What are the key properties of N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine?
N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine has a molecular weight of 214.35 g/mol, XLogP of 1.51, 10 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N'-(2-methoxyethyl)-N-propan-2-yl-N'-prop-2-enylpropane-1,3-diamine is sourced from PubChem (CID 103339315), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).