1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine

C16H16N4 — CID 102942328

IUPAC1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine
SMILESNc1nn(-c2cccc3ncccc23)c2c1CCCC2
InChIInChI=1S/C16H16N4/c17-16-12-5-1-2-8-15(12)20(19-16)14-9-3-7-13-11(14)6-4-10-18-13/h3-4,6-7,9-10H,1-2,5,8H2,(H2,17,19)
InChIKeySLPXJXPTSWKFLX-UHFFFAOYSA-N
MW264.33 g/mol
LogP2.88
Rot. Bonds1

About 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine

1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine (PubChem CID 102942328) has the molecular formula C16H16N4 and a molecular weight of 264.33 g/mol. Its IUPAC name is 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine.

Molecular Properties

Compound Name1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine
PubChem CID102942328
Molecular FormulaC16H16N4
Molecular Weight264.33 g/mol
Exact Mass264.14
IUPAC Name1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine
SMILESNc1nn(-c2cccc3ncccc23)c2c1CCCC2
InChIInChI=1S/C16H16N4/c17-16-12-5-1-2-8-15(12)20(19-16)14-9-3-7-13-11(14)6-4-10-18-13/h3-4,6-7,9-10H,1-2,5,8H2,(H2,17,19)
InChIKeySLPXJXPTSWKFLX-UHFFFAOYSA-N
XLogP2.88
TPSA56.73 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500264.33
LogP ≤ 52.88
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-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

1-(2-bromo-3-methylphenyl)-5,6-dihydro-4H-cyclopenta[d]pyrazol-3-amine
CID 102943027
1-quinolin-5-yltetrazol-5-amine
CID 79506210
5-pyrrolidin-1-ylquinoline
CID 118731129
5-piperidin-1-ylquinoline
CID 12887802
1-(2-chloro-4-iodophenyl)-4,5,6,7-tetrahydroindazol-3-amine
CID 107608587
1-(5-bromo-2-iodophenyl)-4,5,6,7-tetrahydroindazol-3-amine
CID 114261534
5-(5-cyclobutylpyrazol-1-yl)quinoline
CID 139907297
1-(2,4,6-trichlorophenyl)-4,5,6,7-tetrahydroindazol-3-amine
CID 102942490
1-naphthalen-2-yl-4,5,6,7-tetrahydroindazol-3-amine
CID 102942370
2-quinolin-5-yl-1,3-dihydroisoindol-5-amine
CID 43370073
5-imidazo[4,5-b]pyrazin-3-ylquinoline
CID 67318104
1-quinolin-5-yl-1,4-diazepane-2,5-dione
CID 64956527

Frequently Asked Questions

What is the IUPAC name of 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine?
The IUPAC name of 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine (CID 102942328) is 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine.
What is the SMILES notation for 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine?
The canonical SMILES for 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine is Nc1nn(-c2cccc3ncccc23)c2c1CCCC2.
What is the InChIKey of 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine?
The InChIKey is SLPXJXPTSWKFLX-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H16N4/c17-16-12-5-1-2-8-15(12)20(19-16)14-9-3-7-13-11(14)6-4-10-18-13/h3-4,6-7,9-10H,1-2,5,8H2,(H2,17,19).
What are the key properties of 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine?
1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine has a molecular weight of 264.33 g/mol, XLogP of 2.88, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-quinolin-5-yl-4,5,6,7-tetrahydroindazol-3-amine is sourced from PubChem (CID 102942328), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).