N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine

C11H24N2O — CID 103069715

IUPACN-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine
SMILESC=C(CNCCC)CN(C)CCOC
InChIInChI=1S/C11H24N2O/c1-5-6-12-9-11(2)10-13(3)7-8-14-4/h12H,2,5-10H2,1,3-4H3
InChIKeyXUNJPFBSRDKLMR-UHFFFAOYSA-N
MW200.33 g/mol
LogP1.12
Rot. Bonds9

About N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine

N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine (PubChem CID 103069715) has the molecular formula C11H24N2O and a molecular weight of 200.33 g/mol. Its IUPAC name is N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine.

Molecular Properties

Compound NameN-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine
PubChem CID103069715
Molecular FormulaC11H24N2O
Molecular Weight200.33 g/mol
Exact Mass200.19
IUPAC NameN-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine
SMILESC=C(CNCCC)CN(C)CCOC
InChIInChI=1S/C11H24N2O/c1-5-6-12-9-11(2)10-13(3)7-8-14-4/h12H,2,5-10H2,1,3-4H3
InChIKeyXUNJPFBSRDKLMR-UHFFFAOYSA-N
XLogP1.12
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds9
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500200.33
LogP ≤ 51.12
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

(E)-2-methyl-N-(3-morpholin-4-ylpropyl)but-2-en-1-amine
CID 20529045
2-methyl-N-(3-morpholin-4-ylpropyl)but-2-en-1-amine
CID 53925762
N-(2-methoxyethyl)-2-methylprop-2-en-1-amine
CID 57257631
N-(2-ethoxyethyl)-3-methylbut-2-en-1-amine
CID 60061035
N-(2-ethoxyethyl)-2-methylprop-2-en-1-amine
CID 60061045
2-methyl-N-(2-morpholin-4-ylethyl)prop-2-en-1-amine
CID 60687136
2-methyl-N-(2-propan-2-yloxyethyl)prop-2-en-1-amine
CID 104760084
2-Methoxy-3-(3-methyl-2,5-dihydropyrrol-1-yl)propan-1-amine
CID 123192097
N,N'-bis(2-ethenoxyethyl)-2-methylidenepropane-1,3-diamine
CID 129257616
N'-(3-methoxypropyl)-N,N'-dimethylpropane-1,3-diamine;2-methylprop-1-ene;molecular hydrogen
CID 145385314
N-[2-[2-(prop-2-enylamino)ethoxy]ethyl]propan-1-amine
CID 163853615
Dilithium bis(2-methanidylprop-2-enyl-bis(2-methoxyethyl)azanium)
CID 50932750

Frequently Asked Questions

What is the IUPAC name of N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The IUPAC name of N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine (CID 103069715) is N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine.
What is the SMILES notation for N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The canonical SMILES for N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine is C=C(CNCCC)CN(C)CCOC.
What is the InChIKey of N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
The InChIKey is XUNJPFBSRDKLMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H24N2O/c1-5-6-12-9-11(2)10-13(3)7-8-14-4/h12H,2,5-10H2,1,3-4H3.
What are the key properties of N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine?
N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine has a molecular weight of 200.33 g/mol, XLogP of 1.12, 9 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(2-methoxyethyl)-N-methyl-2-methylidene-N'-propylpropane-1,3-diamine is sourced from PubChem (CID 103069715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).