(Z)-3-morpholin-4-ylbut-2-enamide

C8H14N2O2 — CID 70579814

IUPAC(Z)-3-morpholin-4-ylbut-2-enamide
SMILESC/C(=C/C(N)=O)N1CCOCC1
InChIInChI=1S/C8H14N2O2/c1-7(6-8(9)11)10-2-4-12-5-3-10/h6H,2-5H2,1H3,(H2,9,11)/b7-6-
InChIKeyJVGDSKLPDLCXFB-SREVYHEPSA-N
MW170.21 g/mol
LogP-0.29
Rot. Bonds2

About (Z)-3-morpholin-4-ylbut-2-enamide

(Z)-3-morpholin-4-ylbut-2-enamide (PubChem CID 70579814) has the molecular formula C8H14N2O2 and a molecular weight of 170.21 g/mol. Its IUPAC name is (Z)-3-morpholin-4-ylbut-2-enamide.

Molecular Properties

Compound Name(Z)-3-morpholin-4-ylbut-2-enamide
PubChem CID70579814
Molecular FormulaC8H14N2O2
Molecular Weight170.21 g/mol
Exact Mass170.11
IUPAC Name(Z)-3-morpholin-4-ylbut-2-enamide
SMILESC/C(=C/C(N)=O)N1CCOCC1
InChIInChI=1S/C8H14N2O2/c1-7(6-8(9)11)10-2-4-12-5-3-10/h6H,2-5H2,1H3,(H2,9,11)/b7-6-
InChIKeyJVGDSKLPDLCXFB-SREVYHEPSA-N
XLogP-0.29
TPSA55.56 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms12
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500170.21
LogP ≤ 5-0.29
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Michael_acceptor_1', 'substructure': 'N/A'}

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Related Compounds

4-morpholin-4-ylpent-3-en-2-one
CID 592427
1-(1,4,7,10,13,16,19-heptaoxa-22-azacyclotetracos-22-yl)ethanone
CID 20707611
1-(1,4,7,10,13-pentaoxa-16-azacyclooctadec-16-yl)ethanone
CID 10335257
1-(1,4,7-trioxa-10-azacyclododec-10-yl)ethanone
CID 949153
(E)-1-(4-fluorophenyl)-3-morpholin-4-ylbut-2-en-1-one
CID 6510007
(E)-1-(4-chlorophenyl)-3-morpholin-4-ylbut-2-en-1-one
CID 2290884
1-(4-bromophenyl)-3-morpholin-4-ylbut-2-en-1-one
CID 799118
1-[4-[4-(morpholine-4-carbonyl)cyclohexanecarbonyl]piperazin-1-yl]ethanone
CID 109146746
(2E)-3-amino-5-methyl-1-morpholin-4-ylhexa-2,4-diene-1-thione
CID 45118722
(1E,3E)-1-chloro-2-methyl-4-morpholin-4-ylbuta-1,3-diene-1,4-diamine
CID 143881894
morpholine-4-carbaldehyde;1-morpholin-4-ylethanone
CID 158454049
(E)-1,4-dimorpholin-4-ylbut-2-ene-1,4-dione
CID 728972

Frequently Asked Questions

What is the IUPAC name of (Z)-3-morpholin-4-ylbut-2-enamide?
The IUPAC name of (Z)-3-morpholin-4-ylbut-2-enamide (CID 70579814) is (Z)-3-morpholin-4-ylbut-2-enamide.
What is the SMILES notation for (Z)-3-morpholin-4-ylbut-2-enamide?
The canonical SMILES for (Z)-3-morpholin-4-ylbut-2-enamide is C/C(=C/C(N)=O)N1CCOCC1.
What is the InChIKey of (Z)-3-morpholin-4-ylbut-2-enamide?
The InChIKey is JVGDSKLPDLCXFB-SREVYHEPSA-N. The full InChI is InChI=1S/C8H14N2O2/c1-7(6-8(9)11)10-2-4-12-5-3-10/h6H,2-5H2,1H3,(H2,9,11)/b7-6-.
What are the key properties of (Z)-3-morpholin-4-ylbut-2-enamide?
(Z)-3-morpholin-4-ylbut-2-enamide has a molecular weight of 170.21 g/mol, XLogP of -0.29, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-morpholin-4-ylbut-2-enamide is sourced from PubChem (CID 70579814), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).