1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine

C17H23N3O — CID 65356554

IUPAC1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCCNC1CCCc2c1cnn2-c1ccc(OC)cc1
InChIInChI=1S/C17H23N3O/c1-3-11-18-16-5-4-6-17-15(16)12-19-20(17)13-7-9-14(21-2)10-8-13/h7-10,12,16,18H,3-6,11H2,1-2H3
InChIKeyLDPTXMMJLJMOSE-UHFFFAOYSA-N
MW285.39 g/mol
LogP3.26
Rot. Bonds5

About 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine

1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine (PubChem CID 65356554) has the molecular formula C17H23N3O and a molecular weight of 285.39 g/mol. Its IUPAC name is 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine.

Molecular Properties

Compound Name1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine
PubChem CID65356554
Molecular FormulaC17H23N3O
Molecular Weight285.39 g/mol
Exact Mass285.18
IUPAC Name1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine
SMILESCCCNC1CCCc2c1cnn2-c1ccc(OC)cc1
InChIInChI=1S/C17H23N3O/c1-3-11-18-16-5-4-6-17-15(16)12-19-20(17)13-7-9-14(21-2)10-8-13/h7-10,12,16,18H,3-6,11H2,1-2H3
InChIKeyLDPTXMMJLJMOSE-UHFFFAOYSA-N
XLogP3.26
TPSA39.08 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500285.39
LogP ≤ 53.26
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-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 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine?
The IUPAC name of 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine (CID 65356554) is 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine.
What is the SMILES notation for 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine?
The canonical SMILES for 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine is CCCNC1CCCc2c1cnn2-c1ccc(OC)cc1.
What is the InChIKey of 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine?
The InChIKey is LDPTXMMJLJMOSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H23N3O/c1-3-11-18-16-5-4-6-17-15(16)12-19-20(17)13-7-9-14(21-2)10-8-13/h7-10,12,16,18H,3-6,11H2,1-2H3.
What are the key properties of 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine?
1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine has a molecular weight of 285.39 g/mol, XLogP of 3.26, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(4-methoxyphenyl)-N-propyl-4,5,6,7-tetrahydroindazol-4-amine is sourced from PubChem (CID 65356554), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).