4-hydroxy-2-propan-2-ylpent-4-enamide

C8H15NO2 — CID 145216549

IUPAC4-hydroxy-2-propan-2-ylpent-4-enamide
SMILESC=C(O)CC(C(N)=O)C(C)C
InChIInChI=1S/C8H15NO2/c1-5(2)7(8(9)11)4-6(3)10/h5,7,10H,3-4H2,1-2H3,(H2,9,11)
InChIKeyKJXKLISXBISDSZ-UHFFFAOYSA-N
MW157.21 g/mol
LogP1.21
Rot. Bonds4

About 4-hydroxy-2-propan-2-ylpent-4-enamide

4-hydroxy-2-propan-2-ylpent-4-enamide (PubChem CID 145216549) has the molecular formula C8H15NO2 and a molecular weight of 157.21 g/mol. Its IUPAC name is 4-hydroxy-2-propan-2-ylpent-4-enamide.

Molecular Properties

Compound Name4-hydroxy-2-propan-2-ylpent-4-enamide
PubChem CID145216549
Molecular FormulaC8H15NO2
Molecular Weight157.21 g/mol
Exact Mass157.11
IUPAC Name4-hydroxy-2-propan-2-ylpent-4-enamide
SMILESC=C(O)CC(C(N)=O)C(C)C
InChIInChI=1S/C8H15NO2/c1-5(2)7(8(9)11)4-6(3)10/h5,7,10H,3-4H2,1-2H3,(H2,9,11)
InChIKeyKJXKLISXBISDSZ-UHFFFAOYSA-N
XLogP1.21
TPSA63.32 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.21
LogP ≤ 51.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'acyclic_C=C-O', 'substructure': 'N/A'}

Analyze 4-hydroxy-2-propan-2-ylpent-4-enamide with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

3-carbamoyl-4,5-dimethylhexanoic acid
CID 145216564
ethyl 4-chloro-2-propan-2-ylpent-4-enoate
CID 13370940
(E,2S,7S)-2,7-di(propan-2-yl)oct-4-enediamide
CID 88590733
2-propan-2-yl-4-sulfanylpentanamide
CID 126656807
(2R)-4-iodo-2-propan-2-ylpentanamide
CID 89289820
(3S)-3-(hydroxymethyl)-4-methyl-2-methylidenepentanamide
CID 11159459
ethyl 5-carbamoyl-4-oxo-2-propan-2-ylheptanoate
CID 170987152
ethyl 4-formyl-3-propan-2-ylpent-4-enoate
CID 151463470
3-[(1-amino-3-methyl-1-oxobutan-2-yl)amino]butanoic acid
CID 106344813
2-butan-2-ylbutanediamide
CID 87535883
4-methyl-2-methylidenehexanamide
CID 87496757
ethane;3-ethyl-4-methylpent-1-en-2-amine
CID 143289250

Frequently Asked Questions

What is the IUPAC name of 4-hydroxy-2-propan-2-ylpent-4-enamide?
The IUPAC name of 4-hydroxy-2-propan-2-ylpent-4-enamide (CID 145216549) is 4-hydroxy-2-propan-2-ylpent-4-enamide.
What is the SMILES notation for 4-hydroxy-2-propan-2-ylpent-4-enamide?
The canonical SMILES for 4-hydroxy-2-propan-2-ylpent-4-enamide is C=C(O)CC(C(N)=O)C(C)C.
What is the InChIKey of 4-hydroxy-2-propan-2-ylpent-4-enamide?
The InChIKey is KJXKLISXBISDSZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H15NO2/c1-5(2)7(8(9)11)4-6(3)10/h5,7,10H,3-4H2,1-2H3,(H2,9,11).
What are the key properties of 4-hydroxy-2-propan-2-ylpent-4-enamide?
4-hydroxy-2-propan-2-ylpent-4-enamide has a molecular weight of 157.21 g/mol, XLogP of 1.21, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 4-hydroxy-2-propan-2-ylpent-4-enamide is sourced from PubChem (CID 145216549), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).