[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone

C8H10N2O — CID 141295303

IUPAC[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone
SMILESCN(C)C1N=CC=CC1=C=O
InChIInChI=1S/C8H10N2O/c1-10(2)8-7(6-11)4-3-5-9-8/h3-5,8H,1-2H3
InChIKeyNGONVBRMOXJUJN-UHFFFAOYSA-N
MW150.18 g/mol
LogP0.27
Rot. Bonds1

About [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone

[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone (PubChem CID 141295303) has the molecular formula C8H10N2O and a molecular weight of 150.18 g/mol. Its IUPAC name is [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone.

Molecular Properties

Compound Name[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone
PubChem CID141295303
Molecular FormulaC8H10N2O
Molecular Weight150.18 g/mol
Exact Mass150.08
IUPAC Name[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone
SMILESCN(C)C1N=CC=CC1=C=O
InChIInChI=1S/C8H10N2O/c1-10(2)8-7(6-11)4-3-5-9-8/h3-5,8H,1-2H3
InChIKeyNGONVBRMOXJUJN-UHFFFAOYSA-N
XLogP0.27
TPSA32.67 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500150.18
LogP ≤ 50.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

Analyze [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone with MolForge

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

Launch Full Analysis

Frequently Asked Questions

What is the IUPAC name of [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone?
The IUPAC name of [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone (CID 141295303) is [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone.
What is the SMILES notation for [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone?
The canonical SMILES for [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone is CN(C)C1N=CC=CC1=C=O.
What is the InChIKey of [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone?
The InChIKey is NGONVBRMOXJUJN-UHFFFAOYSA-N. The full InChI is InChI=1S/C8H10N2O/c1-10(2)8-7(6-11)4-3-5-9-8/h3-5,8H,1-2H3.
What are the key properties of [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone?
[2-(dimethylamino)-2H-pyridin-3-ylidene]methanone has a molecular weight of 150.18 g/mol, XLogP of 0.27, 1 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(dimethylamino)-2H-pyridin-3-ylidene]methanone is sourced from PubChem (CID 141295303), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).