N,N-bis(2-methoxyethyl)prop-2-en-1-amine

C9H19NO2 — CID 581788

IUPACN,N-bis(2-methoxyethyl)prop-2-en-1-amine
SMILESC=CCN(CCOC)CCOC
InChIInChI=1S/C9H19NO2/c1-4-5-10(6-8-11-2)7-9-12-3/h4H,1,5-9H2,2-3H3
InChIKeyWTIZZWVMLVWCDE-UHFFFAOYSA-N
MW173.26 g/mol
LogP0.77
Rot. Bonds8

About N,N-bis(2-methoxyethyl)prop-2-en-1-amine

N,N-bis(2-methoxyethyl)prop-2-en-1-amine (PubChem CID 581788) has the molecular formula C9H19NO2 and a molecular weight of 173.26 g/mol. Its IUPAC name is N,N-bis(2-methoxyethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN,N-bis(2-methoxyethyl)prop-2-en-1-amine
PubChem CID581788
Molecular FormulaC9H19NO2
Molecular Weight173.26 g/mol
Exact Mass173.14
IUPAC NameN,N-bis(2-methoxyethyl)prop-2-en-1-amine
SMILESC=CCN(CCOC)CCOC
InChIInChI=1S/C9H19NO2/c1-4-5-10(6-8-11-2)7-9-12-3/h4H,1,5-9H2,2-3H3
InChIKeyWTIZZWVMLVWCDE-UHFFFAOYSA-N
XLogP0.77
TPSA21.70 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500173.26
LogP ≤ 50.77
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Related Compounds

N,N-Diethyl-2-[(prop-2-en-1-yl)oxy]ethan-1-amine
CID 261282
4,4-Bis(prop-2-enyl)morpholin-4-ium
CID 3143098
4-Methyl-4-(prop-2-en-1-yl)morpholin-4-ium
CID 18617911
Ammonium, oxydiethylenebis(allyldimethyl-, dibromide
CID 46901
16-(Prop-2-en-1-yl)-1,4,7,10,13-pentaoxa-16-azacyclooctadecane
CID 12458294
N-(2-methoxyethyl)-N-methylprop-2-en-1-amine
CID 17986150
n-Allyl-n-methylmorpholinium bromide
CID 18617910
2-[Bis(prop-2-enyl)amino]ethyl acetate
CID 58105020
4-Ethyl-4-prop-2-enylmorpholin-4-ium
CID 68589736
2-[2-[Dimethyl(prop-2-enyl)azaniumyl]ethoxy]ethyl-dimethyl-prop-2-enylazanium
CID 46902
13-Prop-2-enyl-1,4,7,10-tetraoxa-13-azacyclopentadecane
CID 12458293
4-Allyl-4-ethylmorpholinium chloride
CID 139075365

Frequently Asked Questions

What is the IUPAC name of N,N-bis(2-methoxyethyl)prop-2-en-1-amine?
The IUPAC name of N,N-bis(2-methoxyethyl)prop-2-en-1-amine (CID 581788) is N,N-bis(2-methoxyethyl)prop-2-en-1-amine.
What is the SMILES notation for N,N-bis(2-methoxyethyl)prop-2-en-1-amine?
The canonical SMILES for N,N-bis(2-methoxyethyl)prop-2-en-1-amine is C=CCN(CCOC)CCOC.
What is the InChIKey of N,N-bis(2-methoxyethyl)prop-2-en-1-amine?
The InChIKey is WTIZZWVMLVWCDE-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO2/c1-4-5-10(6-8-11-2)7-9-12-3/h4H,1,5-9H2,2-3H3.
What are the key properties of N,N-bis(2-methoxyethyl)prop-2-en-1-amine?
N,N-bis(2-methoxyethyl)prop-2-en-1-amine has a molecular weight of 173.26 g/mol, XLogP of 0.77, 8 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-bis(2-methoxyethyl)prop-2-en-1-amine is sourced from PubChem (CID 581788), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).