(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide

C9H10N2O2 — CID 55267756

IUPAC(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide
SMILESCOc1ccc(/C=C\C(N)=O)cn1
InChIInChI=1S/C9H10N2O2/c1-13-9-5-3-7(6-11-9)2-4-8(10)12/h2-6H,1H3,(H2,10,12)/b4-2-
InChIKeyIGDLFFOMOHPICQ-RQOWECAXSA-N
MW178.19 g/mol
LogP0.59
Rot. Bonds3

About (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide

(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide (PubChem CID 55267756) has the molecular formula C9H10N2O2 and a molecular weight of 178.19 g/mol. Its IUPAC name is (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide.

Molecular Properties

Compound Name(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide
PubChem CID55267756
Molecular FormulaC9H10N2O2
Molecular Weight178.19 g/mol
Exact Mass178.07
IUPAC Name(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide
SMILESCOc1ccc(/C=C\C(N)=O)cn1
InChIInChI=1S/C9H10N2O2/c1-13-9-5-3-7(6-11-9)2-4-8(10)12/h2-6H,1H3,(H2,10,12)/b4-2-
InChIKeyIGDLFFOMOHPICQ-RQOWECAXSA-N
XLogP0.59
TPSA65.21 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.19
LogP ≤ 50.59
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze (Z)-3-(6-methoxy-3-pyridinyl)prop-2-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

(E)-4-(6-methoxy-3-pyridinyl)but-3-en-2-one
CID 90890451
(1E,4E)-1-(2-methoxy-4-pyridinyl)-5-(6-methoxy-3-pyridinyl)penta-1,4-dien-3-one
CID 58442631
(Z)-3-(6-chloro-3-pyridinyl)prop-2-enamide
CID 55267916
2-methoxy-5-[(Z)-2-methoxyethenyl]pyridine
CID 45091043
6-methoxypyridine-3-carbaldehyde
CID 3364576
(E)-4-(6-methoxy-3-pyridinyl)but-3-en-2-ol
CID 114939091
2-methoxy-5-[(Z)-2-nitrosoprop-1-enyl]pyridine
CID 89164549
3-[4-(3-amino-3-oxoprop-1-enyl)phenyl]prop-2-enamide
CID 2749161
(E)-3-(6-ethoxy-3-pyridinyl)prop-2-enoic acid
CID 67696229
3-(6-cyano-3-pyridinyl)prop-2-enamide
CID 169481486
2-methoxy-5-(2-nitroethenyl)pyridine
CID 67230839
N-[4-(6-methoxy-3-pyridinyl)but-3-enyl]acetamide
CID 170488425

Frequently Asked Questions

What is the IUPAC name of (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide?
The IUPAC name of (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide (CID 55267756) is (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide.
What is the SMILES notation for (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide?
The canonical SMILES for (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide is COc1ccc(/C=C\C(N)=O)cn1.
What is the InChIKey of (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide?
The InChIKey is IGDLFFOMOHPICQ-RQOWECAXSA-N. The full InChI is InChI=1S/C9H10N2O2/c1-13-9-5-3-7(6-11-9)2-4-8(10)12/h2-6H,1H3,(H2,10,12)/b4-2-.
What are the key properties of (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide?
(Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide has a molecular weight of 178.19 g/mol, XLogP of 0.59, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (Z)-3-(6-methoxy-3-pyridinyl)prop-2-enamide is sourced from PubChem (CID 55267756), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).