(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine

C10H20N2O — CID 143222411

IUPAC(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine
SMILESC/C=C(\C)NCCN1CCOCC1
InChIInChI=1S/C10H20N2O/c1-3-10(2)11-4-5-12-6-8-13-9-7-12/h3,11H,4-9H2,1-2H3/b10-3+
InChIKeyXJMLDIHILYODEX-XCVCLJGOSA-N
MW184.28 g/mol
LogP0.83
Rot. Bonds4

About (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine

(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine (PubChem CID 143222411) has the molecular formula C10H20N2O and a molecular weight of 184.28 g/mol. Its IUPAC name is (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine.

Molecular Properties

Compound Name(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine
PubChem CID143222411
Molecular FormulaC10H20N2O
Molecular Weight184.28 g/mol
Exact Mass184.16
IUPAC Name(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine
SMILESC/C=C(\C)NCCN1CCOCC1
InChIInChI=1S/C10H20N2O/c1-3-10(2)11-4-5-12-6-8-13-9-7-12/h3,11H,4-9H2,1-2H3/b10-3+
InChIKeyXJMLDIHILYODEX-XCVCLJGOSA-N
XLogP0.83
TPSA24.50 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500184.28
LogP ≤ 50.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine?
The IUPAC name of (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine (CID 143222411) is (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine.
What is the SMILES notation for (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine?
The canonical SMILES for (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine is C/C=C(\C)NCCN1CCOCC1.
What is the InChIKey of (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine?
The InChIKey is XJMLDIHILYODEX-XCVCLJGOSA-N. The full InChI is InChI=1S/C10H20N2O/c1-3-10(2)11-4-5-12-6-8-13-9-7-12/h3,11H,4-9H2,1-2H3/b10-3+.
What are the key properties of (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine?
(E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine has a molecular weight of 184.28 g/mol, XLogP of 0.83, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (E)-N-(2-morpholin-4-ylethyl)but-2-en-2-amine is sourced from PubChem (CID 143222411), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).