1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine

C14H25N3O — CID 103031442

IUPAC1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine
SMILESCCc1nnc(C)cc1C(N)CCC(C)(C)OC
InChIInChI=1S/C14H25N3O/c1-6-13-11(9-10(2)16-17-13)12(15)7-8-14(3,4)18-5/h9,12H,6-8,15H2,1-5H3
InChIKeyLQVPNQHSZPVSHG-UHFFFAOYSA-N
MW251.37 g/mol
LogP2.55
Rot. Bonds6

About 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine

1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine (PubChem CID 103031442) has the molecular formula C14H25N3O and a molecular weight of 251.37 g/mol. Its IUPAC name is 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine.

Molecular Properties

Compound Name1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine
PubChem CID103031442
Molecular FormulaC14H25N3O
Molecular Weight251.37 g/mol
Exact Mass251.20
IUPAC Name1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine
SMILESCCc1nnc(C)cc1C(N)CCC(C)(C)OC
InChIInChI=1S/C14H25N3O/c1-6-13-11(9-10(2)16-17-13)12(15)7-8-14(3,4)18-5/h9,12H,6-8,15H2,1-5H3
InChIKeyLQVPNQHSZPVSHG-UHFFFAOYSA-N
XLogP2.55
TPSA61.03 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500251.37
LogP ≤ 52.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

1-(3-ethyl-6-methylpyridazin-4-yl)-4-methylsulfonylbutan-1-amine
CID 105113206
1-(2-ethylphenyl)-4-methoxy-4-methylpentan-1-amine
CID 103031433
1-(3-ethyl-6-methylpyridazin-4-yl)-2-methylpentan-1-amine
CID 107894057
(3-ethyl-6-methylpyridazin-4-yl)-(2-methoxyphenyl)methanamine
CID 105093493
N-ethyl-1-(3-ethyl-6-methylpyridazin-4-yl)-4,4-dimethylpentan-1-amine
CID 105140055
1-(3-ethyl-6-methylpyridazin-4-yl)-2-(4-iodophenyl)ethanamine
CID 105151946
1-(3-ethyl-6-methylpyridazin-4-yl)-4-(oxolan-2-yl)butan-1-amine
CID 105156648
1-(3,6-dimethylpyridazin-4-yl)-5,5-dimethylhexan-1-amine
CID 114210905
(3,4-dimethoxyphenyl)-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 105141233
1-(2,5-dichlorothiophen-3-yl)-4-methoxy-4-methylpentan-1-amine
CID 107969416
cycloheptyl-(3-ethyl-6-methylpyridazin-4-yl)methanamine
CID 105176345
4-methoxy-4-methyl-1-naphthalen-1-ylpentan-1-amine
CID 103031528

Frequently Asked Questions

What is the IUPAC name of 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine?
The IUPAC name of 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine (CID 103031442) is 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine.
What is the SMILES notation for 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine?
The canonical SMILES for 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine is CCc1nnc(C)cc1C(N)CCC(C)(C)OC.
What is the InChIKey of 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine?
The InChIKey is LQVPNQHSZPVSHG-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N3O/c1-6-13-11(9-10(2)16-17-13)12(15)7-8-14(3,4)18-5/h9,12H,6-8,15H2,1-5H3.
What are the key properties of 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine?
1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine has a molecular weight of 251.37 g/mol, XLogP of 2.55, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-ethyl-6-methylpyridazin-4-yl)-4-methoxy-4-methylpentan-1-amine is sourced from PubChem (CID 103031442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).