N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine

C17H22N4 — CID 10660565

IUPACN-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine
SMILESCCN1CCCC1CNc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H22N4/c1-2-21-12-6-9-15(21)13-18-17-11-10-16(19-20-17)14-7-4-3-5-8-14/h3-5,7-8,10-11,15H,2,6,9,12-13H2,1H3,(H,18,20)
InChIKeyFKKUKXIZMFRTEH-UHFFFAOYSA-N
MW282.39 g/mol
LogP3.04
Rot. Bonds5

About N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine

N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine (PubChem CID 10660565) has the molecular formula C17H22N4 and a molecular weight of 282.39 g/mol. Its IUPAC name is N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine.

Molecular Properties

Compound NameN-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine
PubChem CID10660565
Molecular FormulaC17H22N4
Molecular Weight282.39 g/mol
Exact Mass282.18
IUPAC NameN-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine
SMILESCCN1CCCC1CNc1ccc(-c2ccccc2)nn1
InChIInChI=1S/C17H22N4/c1-2-21-12-6-9-15(21)13-18-17-11-10-16(19-20-17)14-7-4-3-5-8-14/h3-5,7-8,10-11,15H,2,6,9,12-13H2,1H3,(H,18,20)
InChIKeyFKKUKXIZMFRTEH-UHFFFAOYSA-N
XLogP3.04
TPSA41.05 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.39
LogP ≤ 53.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-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 N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine?
The IUPAC name of N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine (CID 10660565) is N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine.
What is the SMILES notation for N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine?
The canonical SMILES for N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine is CCN1CCCC1CNc1ccc(-c2ccccc2)nn1.
What is the InChIKey of N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine?
The InChIKey is FKKUKXIZMFRTEH-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H22N4/c1-2-21-12-6-9-15(21)13-18-17-11-10-16(19-20-17)14-7-4-3-5-8-14/h3-5,7-8,10-11,15H,2,6,9,12-13H2,1H3,(H,18,20).
What are the key properties of N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine?
N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine has a molecular weight of 282.39 g/mol, XLogP of 3.04, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(1-ethylpyrrolidin-2-yl)methyl]-6-phenylpyridazin-3-amine is sourced from PubChem (CID 10660565), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).