N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine

C17H16N4 — CID 59867354

IUPACN,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine
SMILESCN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1
InChIInChI=1S/C17H16N4/c1-21(2)16-12-15(13-8-10-18-11-9-13)17(20-19-16)14-6-4-3-5-7-14/h3-12H,1-2H3
InChIKeyJZNLARIEJUCAJO-UHFFFAOYSA-N
MW276.34 g/mol
LogP3.27
Rot. Bonds3

About N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine

N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine (PubChem CID 59867354) has the molecular formula C17H16N4 and a molecular weight of 276.34 g/mol. Its IUPAC name is N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine.

Molecular Properties

Compound NameN,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine
PubChem CID59867354
Molecular FormulaC17H16N4
Molecular Weight276.34 g/mol
Exact Mass276.14
IUPAC NameN,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine
SMILESCN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1
InChIInChI=1S/C17H16N4/c1-21(2)16-12-15(13-8-10-18-11-9-13)17(20-19-16)14-6-4-3-5-7-14/h3-12H,1-2H3
InChIKeyJZNLARIEJUCAJO-UHFFFAOYSA-N
XLogP3.27
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.34
LogP ≤ 53.27
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine?
The IUPAC name of N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine (CID 59867354) is N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine.
What is the SMILES notation for N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine?
The canonical SMILES for N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine is CN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1.
What is the InChIKey of N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine?
The InChIKey is JZNLARIEJUCAJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H16N4/c1-21(2)16-12-15(13-8-10-18-11-9-13)17(20-19-16)14-6-4-3-5-7-14/h3-12H,1-2H3.
What are the key properties of N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine?
N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine has a molecular weight of 276.34 g/mol, XLogP of 3.27, 3 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,N-dimethyl-6-phenyl-5-pyridin-4-ylpyridazin-3-amine is sourced from PubChem (CID 59867354), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).