(Z)-3-acetylpent-3-enamide

C7H11NO2 — CID 154977238

IUPAC(Z)-3-acetylpent-3-enamide
SMILESC/C=C(/CC(N)=O)C(C)=O
InChIInChI=1S/C7H11NO2/c1-3-6(5(2)9)4-7(8)10/h3H,4H2,1-2H3,(H2,8,10)/b6-3-
InChIKeyYAAHUAIFZJCZOT-UTCJRWHESA-N
MW141.17 g/mol
LogP0.40
Rot. Bonds3

About (Z)-3-acetylpent-3-enamide

(Z)-3-acetylpent-3-enamide (PubChem CID 154977238) has the molecular formula C7H11NO2 and a molecular weight of 141.17 g/mol. Its IUPAC name is (Z)-3-acetylpent-3-enamide.

Molecular Properties

Compound Name(Z)-3-acetylpent-3-enamide
PubChem CID154977238
Molecular FormulaC7H11NO2
Molecular Weight141.17 g/mol
Exact Mass141.08
IUPAC Name(Z)-3-acetylpent-3-enamide
SMILESC/C=C(/CC(N)=O)C(C)=O
InChIInChI=1S/C7H11NO2/c1-3-6(5(2)9)4-7(8)10/h3H,4H2,1-2H3,(H2,8,10)/b6-3-
InChIKeyYAAHUAIFZJCZOT-UTCJRWHESA-N
XLogP0.40
TPSA60.16 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds3
Heavy Atoms10
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500141.17
LogP ≤ 50.40
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

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Related Compounds

3-ethylpent-3-en-2-one
CID 54009630
propanediamide
CID 7911
azane;3-oxobutanamide
CID 172802770
(Z)-2-(2-amino-2-oxoethyl)-4-(methylamino)-4-oxobut-2-enoic acid
CID 90290384
3,5-dimethylhex-3-enamide
CID 76566666
formaldehyde;propanediamide
CID 161283557
3-methylbut-3-enamide;molecular hydrogen
CID 153357956
3-sulfonylbutanamide
CID 87629515
(1,3-diamino-3-oxopropylidene)azanium chloride
CID 11423629
(2E,4E)-4-ethyl-3-methylhexa-2,4-dienamide
CID 14329806
(E)-hept-5-enamide
CID 18415105
(E)-5-hydroxyhept-5-enamide
CID 144921048

Frequently Asked Questions

What is the IUPAC name of (Z)-3-acetylpent-3-enamide?
The IUPAC name of (Z)-3-acetylpent-3-enamide (CID 154977238) is (Z)-3-acetylpent-3-enamide.
What is the SMILES notation for (Z)-3-acetylpent-3-enamide?
The canonical SMILES for (Z)-3-acetylpent-3-enamide is C/C=C(/CC(N)=O)C(C)=O.
What is the InChIKey of (Z)-3-acetylpent-3-enamide?
The InChIKey is YAAHUAIFZJCZOT-UTCJRWHESA-N. The full InChI is InChI=1S/C7H11NO2/c1-3-6(5(2)9)4-7(8)10/h3H,4H2,1-2H3,(H2,8,10)/b6-3-.
What are the key properties of (Z)-3-acetylpent-3-enamide?
(Z)-3-acetylpent-3-enamide has a molecular weight of 141.17 g/mol, XLogP of 0.40, 3 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-acetylpent-3-enamide is sourced from PubChem (CID 154977238), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).