N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine

C9H17NO — CID 121299834

IUPACN-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine
SMILESC=CCOC(C)N(C)CC=C
InChIInChI=1S/C9H17NO/c1-5-7-10(4)9(3)11-8-6-2/h5-6,9H,1-2,7-8H2,3-4H3
InChIKeyDRWCZGNVXQVSTF-UHFFFAOYSA-N
MW155.24 g/mol
LogP1.65
Rot. Bonds6

About N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine

N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine (PubChem CID 121299834) has the molecular formula C9H17NO and a molecular weight of 155.24 g/mol. Its IUPAC name is N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine.

Molecular Properties

Compound NameN-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine
PubChem CID121299834
Molecular FormulaC9H17NO
Molecular Weight155.24 g/mol
Exact Mass155.13
IUPAC NameN-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine
SMILESC=CCOC(C)N(C)CC=C
InChIInChI=1S/C9H17NO/c1-5-7-10(4)9(3)11-8-6-2/h5-6,9H,1-2,7-8H2,3-4H3
InChIKeyDRWCZGNVXQVSTF-UHFFFAOYSA-N
XLogP1.65
TPSA12.47 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500155.24
LogP ≤ 51.65
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'het-C-het_not_in_ring', 'substructure': 'N/A'}, {'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
Allylamine, 3-(allyloxy)-N,N-dimethyl-
CID 6434750
(E)-N,N-diethyl-3-methyl-4-prop-2-enoxybut-2-en-1-amine
CID 14658341
(Allyloxymethyl)triethylammonium iodide
CID 3026346
Trimethyl(2-prop-2-enyloxyethyl)amine
CID 2317160
(E)-3-ethoxy-N,N,N',N'-tetramethylprop-1-ene-1,3-diamine
CID 12226429
1-Methoxy-N,N-dimethylprop-2-en-1-amine
CID 13215411
Trimethyl-[1-(2-methylprop-2-enoxy)ethyl]azanium
CID 19893189
Bis(ethoxymethyl)-bis(prop-2-enyl)azanium chloride
CID 21284600
Bis(ethoxymethyl)-bis(prop-2-enyl)azanium
CID 21284601
3-(allyloxy)-N,N-dimethylpropan-1-amine
CID 22650008
N-methyl-2-prop-2-enoxy-N-(2-prop-2-enoxyethyl)ethanamine
CID 22899058

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine?
The IUPAC name of N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine (CID 121299834) is N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine.
What is the SMILES notation for N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine?
The canonical SMILES for N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine is C=CCOC(C)N(C)CC=C.
What is the InChIKey of N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine?
The InChIKey is DRWCZGNVXQVSTF-UHFFFAOYSA-N. The full InChI is InChI=1S/C9H17NO/c1-5-7-10(4)9(3)11-8-6-2/h5-6,9H,1-2,7-8H2,3-4H3.
What are the key properties of N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine?
N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine has a molecular weight of 155.24 g/mol, XLogP of 1.65, 6 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-prop-2-enoxyethyl)prop-2-en-1-amine is sourced from PubChem (CID 121299834), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).