6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine

C16H21N3O2 — CID 19385475

IUPAC6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine
SMILESCCOc1ccc(-c2ccc(N)nn2)cc1OCC(C)C
InChIInChI=1S/C16H21N3O2/c1-4-20-14-7-5-12(9-15(14)21-10-11(2)3)13-6-8-16(17)19-18-13/h5-9,11H,4,10H2,1-3H3,(H2,17,19)
InChIKeyLRLSGKPQSLUIJO-UHFFFAOYSA-N
MW287.36 g/mol
LogP3.16
Rot. Bonds6

About 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine

6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine (PubChem CID 19385475) has the molecular formula C16H21N3O2 and a molecular weight of 287.36 g/mol. Its IUPAC name is 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine.

Molecular Properties

Compound Name6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine
PubChem CID19385475
Molecular FormulaC16H21N3O2
Molecular Weight287.36 g/mol
Exact Mass287.16
IUPAC Name6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine
SMILESCCOc1ccc(-c2ccc(N)nn2)cc1OCC(C)C
InChIInChI=1S/C16H21N3O2/c1-4-20-14-7-5-12(9-15(14)21-10-11(2)3)13-6-8-16(17)19-18-13/h5-9,11H,4,10H2,1-3H3,(H2,17,19)
InChIKeyLRLSGKPQSLUIJO-UHFFFAOYSA-N
XLogP3.16
TPSA70.26 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 53.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-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

Related Compounds

(2-amino-2-oxoethyl) 3-ethoxy-4-(2-methylpropoxy)benzoate
CID 2535405
6-[3-propan-2-yloxy-4-(trifluoromethyl)phenyl]pyridazin-3-amine
CID 178030240
diethyl 2,5-bis[3,4-bis(2-methylpropoxy)phenyl]benzene-1,4-dicarboxylate
CID 22146246
[2-(carbamoylamino)-2-oxoethyl] 3-ethoxy-4-(2-methylpropoxy)benzoate
CID 2535390
4-[3-ethoxy-4-(2-methylpropoxy)phenyl]-2-methylsulfanyl-6-oxo-1H-pyrimidine-5-carbonitrile
CID 168589735
5-(2-ethyl-1,3-thiazol-4-yl)-2-(2-methylpropoxy)aniline
CID 82057810
1-[6-(4-ethoxy-3-methylphenyl)pyridazin-3-yl]-N-methylmethanamine
CID 95465136
2-methylpropyl 3,4-diethoxybenzoate
CID 82186382
6-(6-ethoxy-2-pyridinyl)pyridazin-3-amine
CID 142791176
5-(4-ethoxy-3-methoxyphenyl)-1H-pyrazol-3-amine
CID 3480116
5-(2-chloropyrimidin-4-yl)-2-(2-methylpropoxy)aniline
CID 88958999
2-chloro-4-(3,4-diethoxyphenyl)aniline
CID 107607652

Frequently Asked Questions

What is the IUPAC name of 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine?
The IUPAC name of 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine (CID 19385475) is 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine.
What is the SMILES notation for 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine?
The canonical SMILES for 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine is CCOc1ccc(-c2ccc(N)nn2)cc1OCC(C)C.
What is the InChIKey of 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine?
The InChIKey is LRLSGKPQSLUIJO-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H21N3O2/c1-4-20-14-7-5-12(9-15(14)21-10-11(2)3)13-6-8-16(17)19-18-13/h5-9,11H,4,10H2,1-3H3,(H2,17,19).
What are the key properties of 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine?
6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine has a molecular weight of 287.36 g/mol, XLogP of 3.16, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[4-ethoxy-3-(2-methylpropoxy)phenyl]pyridazin-3-amine is sourced from PubChem (CID 19385475), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).