ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine

C12H28N2O — CID 177002503

IUPACethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine
SMILESC=C(CNC)N1CCOCC1.CC.CC
InChIInChI=1S/C8H16N2O.2C2H6/c1-8(7-9-2)10-3-5-11-6-4-10;2*1-2/h9H,1,3-7H2,2H3;2*1-2H3
InChIKeyCQHWFPYTXWENOT-UHFFFAOYSA-N
MW216.37 g/mol
LogP2.10
Rot. Bonds3

About ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine

ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine (PubChem CID 177002503) has the molecular formula C12H28N2O and a molecular weight of 216.37 g/mol. Its IUPAC name is ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine.

Molecular Properties

Compound Nameethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine
PubChem CID177002503
Molecular FormulaC12H28N2O
Molecular Weight216.37 g/mol
Exact Mass216.22
IUPAC Nameethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine
SMILESC=C(CNC)N1CCOCC1.CC.CC
InChIInChI=1S/C8H16N2O.2C2H6/c1-8(7-9-2)10-3-5-11-6-4-10;2*1-2/h9H,1,3-7H2,2H3;2*1-2H3
InChIKeyCQHWFPYTXWENOT-UHFFFAOYSA-N
XLogP2.10
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500216.37
LogP ≤ 52.10
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2-(methylamino)acetic acid;morpholine-4-carboxamide
CID 69170925
(2E,4E)-N,2-dimethyl-5-morpholin-4-ylhepta-2,4,6-trien-1-amine
CID 143114266
CID 177489628
CID 177489628
ethane;2-methyl-1-morpholin-4-ylprop-2-en-1-imine
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N,N-dimethyl-1-morpholin-4-ylethenamine
CID 142039322
N-[2-(methylamino)-2-oxoethyl]morpholine-4-carboxamide
CID 115575285
N-methyl-2-[(3-morpholin-4-ylpyrrolidin-1-yl)methyl]prop-2-en-1-amine
CID 103070551
1,3-dimorpholin-4-ylpropane-1,3-diimine
CID 123506612
ethane;1-morpholin-4-ylethanethione
CID 142226083
butane;N-methylmorpholine-4-carboxamide;propane
CID 143336598
2-chloro-1-morpholin-4-ylbutan-1-one
CID 62226878
ethane;2-methyl-2-(methylamino)-1-morpholin-4-ylpropan-1-one
CID 168940917

Frequently Asked Questions

What is the IUPAC name of ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine?
The IUPAC name of ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine (CID 177002503) is ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine.
What is the SMILES notation for ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine?
The canonical SMILES for ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine is C=C(CNC)N1CCOCC1.CC.CC.
What is the InChIKey of ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine?
The InChIKey is CQHWFPYTXWENOT-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H16N2O.2C2H6/c1-8(7-9-2)10-3-5-11-6-4-10;2*1-2/h9H,1,3-7H2,2H3;2*1-2H3.
What are the key properties of ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine?
ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine has a molecular weight of 216.37 g/mol, XLogP of 2.10, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;N-methyl-2-morpholin-4-ylprop-2-en-1-amine is sourced from PubChem (CID 177002503), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).