N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine

C15H17N3 — CID 106895183

IUPACN-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESc1cnnc(CNC2CCc3ccccc3C2)c1
InChIInChI=1S/C15H17N3/c1-2-5-13-10-14(8-7-12(13)4-1)16-11-15-6-3-9-17-18-15/h1-6,9,14,16H,7-8,10-11H2
InChIKeyYMYMYCDFKJSYTH-UHFFFAOYSA-N
MW239.32 g/mol
LogP2.12
Rot. Bonds3

About N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine

N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine (PubChem CID 106895183) has the molecular formula C15H17N3 and a molecular weight of 239.32 g/mol. Its IUPAC name is N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine.

Molecular Properties

Compound NameN-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
PubChem CID106895183
Molecular FormulaC15H17N3
Molecular Weight239.32 g/mol
Exact Mass239.14
IUPAC NameN-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
SMILESc1cnnc(CNC2CCc3ccccc3C2)c1
InChIInChI=1S/C15H17N3/c1-2-5-13-10-14(8-7-12(13)4-1)16-11-15-6-3-9-17-18-15/h1-6,9,14,16H,7-8,10-11H2
InChIKeyYMYMYCDFKJSYTH-UHFFFAOYSA-N
XLogP2.12
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500239.32
LogP ≤ 52.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5-methyl-2-pyridinyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 80707817
(2S)-N-(pyridin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 30983305
N-[(1-tert-butyltriazol-4-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 103399050
N-[(2-chlorophenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 43221477
3,5-dimethyl-N-(pyridazin-3-ylmethyl)cyclohexan-1-amine
CID 106834128
3,4-dimethyl-N-(pyridazin-3-ylmethyl)cyclohexan-1-amine
CID 106833983
N-[(2-methyltetrazol-5-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 107042348
N-[(4-aminophenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 89120982
N-[(3,4-dichlorophenyl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 60658203
3-methoxy-N-(pyridazin-3-ylmethyl)cyclohexan-1-amine
CID 106894953
N-[(1-methylimidazol-2-yl)methyl]-1,2,3,4-tetrahydronaphthalen-2-amine
CID 60695151
7-methoxy-N-(pyridin-2-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine
CID 115510271

Frequently Asked Questions

What is the IUPAC name of N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The IUPAC name of N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine (CID 106895183) is N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine.
What is the SMILES notation for N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The canonical SMILES for N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine is c1cnnc(CNC2CCc3ccccc3C2)c1.
What is the InChIKey of N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
The InChIKey is YMYMYCDFKJSYTH-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H17N3/c1-2-5-13-10-14(8-7-12(13)4-1)16-11-15-6-3-9-17-18-15/h1-6,9,14,16H,7-8,10-11H2.
What are the key properties of N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine?
N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine has a molecular weight of 239.32 g/mol, XLogP of 2.12, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(pyridazin-3-ylmethyl)-1,2,3,4-tetrahydronaphthalen-2-amine is sourced from PubChem (CID 106895183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).