4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine

C10H13N3 — CID 163269559

IUPAC4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine
SMILESC=Cc1c(N=C)cncc1N(C)C
InChIInChI=1S/C10H13N3/c1-5-8-9(11-2)6-12-7-10(8)13(3)4/h5-7H,1-2H2,3-4H3
InChIKeyLAGRCDFVORNARL-UHFFFAOYSA-N
MW175.23 g/mol
LogP2.12
Rot. Bonds3

About 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine

4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine (PubChem CID 163269559) has the molecular formula C10H13N3 and a molecular weight of 175.23 g/mol. Its IUPAC name is 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine.

Molecular Properties

Compound Name4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine
PubChem CID163269559
Molecular FormulaC10H13N3
Molecular Weight175.23 g/mol
Exact Mass175.11
IUPAC Name4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine
SMILESC=Cc1c(N=C)cncc1N(C)C
InChIInChI=1S/C10H13N3/c1-5-8-9(11-2)6-12-7-10(8)13(3)4/h5-7H,1-2H2,3-4H3
InChIKeyLAGRCDFVORNARL-UHFFFAOYSA-N
XLogP2.12
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500175.23
LogP ≤ 52.12
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'imine_1', 'substructure': 'N/A'}

Analyze 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine 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 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine?
The IUPAC name of 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine (CID 163269559) is 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine.
What is the SMILES notation for 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine?
The canonical SMILES for 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine is C=Cc1c(N=C)cncc1N(C)C.
What is the InChIKey of 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine?
The InChIKey is LAGRCDFVORNARL-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H13N3/c1-5-8-9(11-2)6-12-7-10(8)13(3)4/h5-7H,1-2H2,3-4H3.
What are the key properties of 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine?
4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine has a molecular weight of 175.23 g/mol, XLogP of 2.12, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-ethenyl-N,N-dimethyl-5-(methylideneamino)pyridin-3-amine is sourced from PubChem (CID 163269559), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).