N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine

C15H19N3 — CID 105139889

IUPACN-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine
SMILESCNC(CCCc1ccccc1)c1ccnnc1
InChIInChI=1S/C15H19N3/c1-16-15(14-10-11-17-18-12-14)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12,15-16H,5,8-9H2,1H3
InChIKeyRDEPTYTZFDGESF-UHFFFAOYSA-N
MW241.34 g/mol
LogP2.76
Rot. Bonds6

About N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine

N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine (PubChem CID 105139889) has the molecular formula C15H19N3 and a molecular weight of 241.34 g/mol. Its IUPAC name is N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine.

Molecular Properties

Compound NameN-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine
PubChem CID105139889
Molecular FormulaC15H19N3
Molecular Weight241.34 g/mol
Exact Mass241.16
IUPAC NameN-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine
SMILESCNC(CCCc1ccccc1)c1ccnnc1
InChIInChI=1S/C15H19N3/c1-16-15(14-10-11-17-18-12-14)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12,15-16H,5,8-9H2,1H3
InChIKeyRDEPTYTZFDGESF-UHFFFAOYSA-N
XLogP2.76
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.34
LogP ≤ 52.76
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-methyl-1-pyridazin-4-ylnonan-1-amine
CID 105128253
1-(2,6-dimethyl-4-pyridinyl)-N-methyl-4-phenylbutan-1-amine
CID 107503560
1-(3-methoxyphenyl)-N-methyl-4-phenylbutan-1-amine
CID 62606227
1-(1,3-dihydro-2-benzofuran-5-yl)-N-methyl-4-phenylbutan-1-amine
CID 115849427
N-methyl-3-(1-methylimidazol-2-yl)-1-pyridazin-4-ylpropan-1-amine
CID 105187782
1-(3-bromo-5-methylphenyl)-N-methyl-4-phenylbutan-1-amine
CID 115849378
(5-methyl-1-pyridazin-4-ylhexyl)hydrazine
CID 105331323
2-cyclopropyl-N-methyl-1-pyridazin-4-ylethanamine
CID 105152933
N-methyl-1-(2-methylsulfanylphenyl)-4-phenylbutan-1-amine
CID 115849651
1-(2-methoxy-3-pyridinyl)-N-methyl-4-phenylbutan-1-amine
CID 105139852
N,3-dimethyl-6-phenylhexan-2-amine
CID 61485141
2-(7-bicyclo[4.2.0]octa-1,3,5-trienyl)-N-methyl-1-pyridazin-4-ylethanamine
CID 105162851

Frequently Asked Questions

What is the IUPAC name of N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine?
The IUPAC name of N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine (CID 105139889) is N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine.
What is the SMILES notation for N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine?
The canonical SMILES for N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine is CNC(CCCc1ccccc1)c1ccnnc1.
What is the InChIKey of N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine?
The InChIKey is RDEPTYTZFDGESF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19N3/c1-16-15(14-10-11-17-18-12-14)9-5-8-13-6-3-2-4-7-13/h2-4,6-7,10-12,15-16H,5,8-9H2,1H3.
What are the key properties of N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine?
N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine has a molecular weight of 241.34 g/mol, XLogP of 2.76, 6 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-4-phenyl-1-pyridazin-4-ylbutan-1-amine is sourced from PubChem (CID 105139889), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).