N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine

C19H20N4 — CID 121317299

IUPACN-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine
SMILESCCCN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1
InChIInChI=1S/C19H20N4/c1-3-13-23(2)18-14-17(15-9-11-20-12-10-15)19(22-21-18)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3
InChIKeyQAUNWGSLEITSMR-UHFFFAOYSA-N
MW304.40 g/mol
LogP4.05
Rot. Bonds5

About N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine

N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine (PubChem CID 121317299) has the molecular formula C19H20N4 and a molecular weight of 304.40 g/mol. Its IUPAC name is N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine.

Molecular Properties

Compound NameN-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine
PubChem CID121317299
Molecular FormulaC19H20N4
Molecular Weight304.40 g/mol
Exact Mass304.17
IUPAC NameN-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine
SMILESCCCN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1
InChIInChI=1S/C19H20N4/c1-3-13-23(2)18-14-17(15-9-11-20-12-10-15)19(22-21-18)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3
InChIKeyQAUNWGSLEITSMR-UHFFFAOYSA-N
XLogP4.05
TPSA41.91 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500304.40
LogP ≤ 54.05
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine?
The IUPAC name of N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine (CID 121317299) is N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine.
What is the SMILES notation for N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine?
The canonical SMILES for N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine is CCCN(C)c1cc(-c2ccncc2)c(-c2ccccc2)nn1.
What is the InChIKey of N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine?
The InChIKey is QAUNWGSLEITSMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H20N4/c1-3-13-23(2)18-14-17(15-9-11-20-12-10-15)19(22-21-18)16-7-5-4-6-8-16/h4-12,14H,3,13H2,1-2H3.
What are the key properties of N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine?
N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine has a molecular weight of 304.40 g/mol, XLogP of 4.05, 5 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-6-phenyl-N-propyl-5-pyridin-4-ylpyridazin-3-amine is sourced from PubChem (CID 121317299), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).