2-aminopent-2-en-3-ol

C5H11NO — CID 151656039

IUPAC2-aminopent-2-en-3-ol
SMILESCCC(O)=C(C)N
InChIInChI=1S/C5H11NO/c1-3-5(7)4(2)6/h7H,3,6H2,1-2H3
InChIKeyQVNDRBAMOCPRSE-UHFFFAOYSA-N
MW101.15 g/mol
LogP1.14
Rot. Bonds1

About 2-aminopent-2-en-3-ol

2-aminopent-2-en-3-ol (PubChem CID 151656039) has the molecular formula C5H11NO and a molecular weight of 101.15 g/mol. Its IUPAC name is 2-aminopent-2-en-3-ol.

Molecular Properties

Compound Name2-aminopent-2-en-3-ol
PubChem CID151656039
Molecular FormulaC5H11NO
Molecular Weight101.15 g/mol
Exact Mass101.08
IUPAC Name2-aminopent-2-en-3-ol
SMILESCCC(O)=C(C)N
InChIInChI=1S/C5H11NO/c1-3-5(7)4(2)6/h7H,3,6H2,1-2H3
InChIKeyQVNDRBAMOCPRSE-UHFFFAOYSA-N
XLogP1.14
TPSA46.25 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms7
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500101.15
LogP ≤ 51.14
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Computed Properties (RDKit)

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

Analyze 2-aminopent-2-en-3-ol 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

acetylene;ethane;methane;(Z)-3-methylpent-2-en-2-amine
CID 169178718
3-aminobut-2-en-2-ol
CID 76571458
methane;propanamide
CID 160666730
(Z)-3-hydroxy-2-methylpent-2-enoic acid
CID 54723560
propanoic acid;urea
CID 22102181
(E)-3-methyl-4-methylidenehex-2-en-2-amine
CID 177319888
(E)-4-methylhex-3-en-3-amine
CID 129020883
ethanamine;methane;propanoic acid
CID 159582357
bis(butan-2-one);methane
CID 160665705
methane;bis(2-methylbut-1-ene)
CID 160529780
mercury(2+);propanoic acid
CID 23623813
acetamide;acetic acid;ethanamine;propane
CID 160501368

Frequently Asked Questions

What is the IUPAC name of 2-aminopent-2-en-3-ol?
The IUPAC name of 2-aminopent-2-en-3-ol (CID 151656039) is 2-aminopent-2-en-3-ol.
What is the SMILES notation for 2-aminopent-2-en-3-ol?
The canonical SMILES for 2-aminopent-2-en-3-ol is CCC(O)=C(C)N.
What is the InChIKey of 2-aminopent-2-en-3-ol?
The InChIKey is QVNDRBAMOCPRSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C5H11NO/c1-3-5(7)4(2)6/h7H,3,6H2,1-2H3.
What are the key properties of 2-aminopent-2-en-3-ol?
2-aminopent-2-en-3-ol has a molecular weight of 101.15 g/mol, XLogP of 1.14, 1 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 2-aminopent-2-en-3-ol is sourced from PubChem (CID 151656039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).