N,N-diethyl-2-prop-1-en-2-yloxyethanamine

C9H19NO — CID 57188475

IUPACN,N-diethyl-2-prop-1-en-2-yloxyethanamine
SMILESC=C(C)OCCN(CC)CC
InChIInChI=1S/C9H19NO/c1-5-10(6-2)7-8-11-9(3)4/h3,5-8H2,1-2,4H3
InChIKeyWTDGESFVSOPTFM-UHFFFAOYSA-N
MW157.26 g/mol
LogP1.88
Rot. Bonds6

About N,N-diethyl-2-prop-1-en-2-yloxyethanamine

N,N-diethyl-2-prop-1-en-2-yloxyethanamine (PubChem CID 57188475) has the molecular formula C9H19NO and a molecular weight of 157.26 g/mol. Its IUPAC name is N,N-diethyl-2-prop-1-en-2-yloxyethanamine.

Molecular Properties

Compound NameN,N-diethyl-2-prop-1-en-2-yloxyethanamine
PubChem CID57188475
Molecular FormulaC9H19NO
Molecular Weight157.26 g/mol
Exact Mass157.15
IUPAC NameN,N-diethyl-2-prop-1-en-2-yloxyethanamine
SMILESC=C(C)OCCN(CC)CC
InChIInChI=1S/C9H19NO/c1-5-10(6-2)7-8-11-9(3)4/h3,5-8H2,1-2,4H3
InChIKeyWTDGESFVSOPTFM-UHFFFAOYSA-N
XLogP1.88
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.26
LogP ≤ 51.88
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

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Related Compounds

2-(diethylamino)ethyl 2-methylprop-2-enoate;hydrazine
CID 161237625
2-(3,3-dimethylpent-1-en-2-yloxy)-N,N-diethylethanamine
CID 18717519
[3-[3-[2-(diethylamino)ethoxy]-3-oxopropoxy]-3-oxopropyl] 2-methylprop-2-enoate
CID 20659271
2-(diethylamino)ethyl 2-methylprop-2-enoate;diethyl sulfate
CID 162214981
2-(diethylamino)ethyl propanoate;hydrochloride
CID 141390423
2-[2-ethoxyethyl(ethyl)amino]ethyl 2-methylprop-2-enoate
CID 88906932
2-(diethylamino)ethyl 2-methylhexa-2,5-dienoate
CID 173337637
1,3-bis(prop-1-en-2-yloxy)propane;methane
CID 162270596
chloromethyl 2-(diethylamino)ethyl carbonate
CID 54133141
10-(diethylamino)decyl 2-methylprop-2-enoate
CID 88816088
2-(diethylamino)ethyl 2-methylprop-2-enoate;N-ethylprop-2-enamide;methane
CID 161409865
butyl 2-methylprop-2-enoate;2-(diethylamino)ethyl 2-methylprop-2-enoate;methyl 2-methylprop-2-enoate;octadecyl 2-methylprop-2-enoate
CID 173140815

Frequently Asked Questions

What is the IUPAC name of N,N-diethyl-2-prop-1-en-2-yloxyethanamine?
The IUPAC name of N,N-diethyl-2-prop-1-en-2-yloxyethanamine (CID 57188475) is N,N-diethyl-2-prop-1-en-2-yloxyethanamine.
What is the SMILES notation for N,N-diethyl-2-prop-1-en-2-yloxyethanamine?
The canonical SMILES for N,N-diethyl-2-prop-1-en-2-yloxyethanamine is C=C(C)OCCN(CC)CC.
What is the InChIKey of N,N-diethyl-2-prop-1-en-2-yloxyethanamine?
The InChIKey is WTDGESFVSOPTFM-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H19NO/c1-5-10(6-2)7-8-11-9(3)4/h3,5-8H2,1-2,4H3.
What are the key properties of N,N-diethyl-2-prop-1-en-2-yloxyethanamine?
N,N-diethyl-2-prop-1-en-2-yloxyethanamine has a molecular weight of 157.26 g/mol, XLogP of 1.88, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-diethyl-2-prop-1-en-2-yloxyethanamine is sourced from PubChem (CID 57188475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).