N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline

C14H15N3 — CID 155931686

IUPACN,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline
SMILESCN(C)c1cccc(/N=C/c2ccccn2)c1
InChIInChI=1S/C14H15N3/c1-17(2)14-8-5-7-12(10-14)16-11-13-6-3-4-9-15-13/h3-11H,1-2H3/b16-11+
InChIKeyPDZLPOPJZZZGCC-LFIBNONCSA-N
MW225.30 g/mol
LogP2.90
Rot. Bonds3

About N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline

N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline (PubChem CID 155931686) has the molecular formula C14H15N3 and a molecular weight of 225.30 g/mol. Its IUPAC name is N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline.

Molecular Properties

Compound NameN,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline
PubChem CID155931686
Molecular FormulaC14H15N3
Molecular Weight225.30 g/mol
Exact Mass225.13
IUPAC NameN,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline
SMILESCN(C)c1cccc(/N=C/c2ccccn2)c1
InChIInChI=1S/C14H15N3/c1-17(2)14-8-5-7-12(10-14)16-11-13-6-3-4-9-15-13/h3-11H,1-2H3/b16-11+
InChIKeyPDZLPOPJZZZGCC-LFIBNONCSA-N
XLogP2.90
TPSA28.49 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500225.30
LogP ≤ 52.90
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

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

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline?
The IUPAC name of N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline (CID 155931686) is N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline.
What is the SMILES notation for N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline?
The canonical SMILES for N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline is CN(C)c1cccc(/N=C/c2ccccn2)c1.
What is the InChIKey of N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline?
The InChIKey is PDZLPOPJZZZGCC-LFIBNONCSA-N. The full InChI is InChI=1S/C14H15N3/c1-17(2)14-8-5-7-12(10-14)16-11-13-6-3-4-9-15-13/h3-11H,1-2H3/b16-11+.
What are the key properties of N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline?
N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline has a molecular weight of 225.30 g/mol, XLogP of 2.90, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-3-(pyridin-2-ylmethylideneamino)aniline is sourced from PubChem (CID 155931686), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).