2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide

C11H17N5O — CID 165474812

IUPAC2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide
SMILESC=CCC(N)C(=O)Nc1ccnn1C1CNC1
InChIInChI=1S/C11H17N5O/c1-2-3-9(12)11(17)15-10-4-5-14-16(10)8-6-13-7-8/h2,4-5,8-9,13H,1,3,6-7,12H2,(H,15,17)
InChIKeyQNYIHVNYIRIMIV-UHFFFAOYSA-N
MW235.29 g/mol
LogP-0.13
Rot. Bonds5

About 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide

2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide (PubChem CID 165474812) has the molecular formula C11H17N5O and a molecular weight of 235.29 g/mol. Its IUPAC name is 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide.

Molecular Properties

Compound Name2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide
PubChem CID165474812
Molecular FormulaC11H17N5O
Molecular Weight235.29 g/mol
Exact Mass235.14
IUPAC Name2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide
SMILESC=CCC(N)C(=O)Nc1ccnn1C1CNC1
InChIInChI=1S/C11H17N5O/c1-2-3-9(12)11(17)15-10-4-5-14-16(10)8-6-13-7-8/h2,4-5,8-9,13H,1,3,6-7,12H2,(H,15,17)
InChIKeyQNYIHVNYIRIMIV-UHFFFAOYSA-N
XLogP-0.13
TPSA84.97 Ų
H-Bond Donors3
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500235.29
LogP ≤ 5-0.13
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 105

Computed Properties (RDKit)

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

Analyze 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-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

(2S)-2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]-3-cyclopropylpropanamide
CID 165484852
2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]hexanamide
CID 165484923
2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]-4-methylsulfanylbutanamide
CID 165482729
N-[2-(azetidin-3-yl)pyrazol-3-yl]-2-carbamothioylbutanamide
CID 165474032
3-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]hexanamide
CID 165484929
N-(2-aminoethyl)-N'-[2-(azetidin-3-yl)pyrazol-3-yl]oxamide
CID 165474686
N-[2-(azetidin-3-yl)pyrazol-3-yl]piperidine-4-carboxamide
CID 165484845
N-[2-(azetidin-3-yl)pyrazol-3-yl]-1-(methylamino)cyclopropane-1-carboxamide
CID 165483514
(3R)-N-[2-(azetidin-3-yl)pyrazol-3-yl]pyrrolidine-3-carboxamide
CID 165482654
2-(azetidin-3-ylidene)-N-[2-(azetidin-3-yl)pyrazol-3-yl]propanamide
CID 165484838
N-[2-(azetidin-3-yl)pyrazol-3-yl]piperazine-2-carboxamide
CID 165474818
2-amino-N-[2-(2-methylpyrazol-3-yl)ethyl]pent-4-enamide
CID 103006628

Frequently Asked Questions

What is the IUPAC name of 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide?
The IUPAC name of 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide (CID 165474812) is 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide.
What is the SMILES notation for 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide?
The canonical SMILES for 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide is C=CCC(N)C(=O)Nc1ccnn1C1CNC1.
What is the InChIKey of 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide?
The InChIKey is QNYIHVNYIRIMIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N5O/c1-2-3-9(12)11(17)15-10-4-5-14-16(10)8-6-13-7-8/h2,4-5,8-9,13H,1,3,6-7,12H2,(H,15,17).
What are the key properties of 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide?
2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide has a molecular weight of 235.29 g/mol, XLogP of -0.13, 5 rotatable bonds, 3 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N-[2-(azetidin-3-yl)pyrazol-3-yl]pent-4-enamide is sourced from PubChem (CID 165474812), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).