6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine

C20H24FN5 — CID 166631634

IUPAC6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
SMILESCc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1ccnc(C)c1F
InChIInChI=1S/C20H24FN5/c1-12-10-17-18(11-16(12)15-4-7-22-13(2)19(15)21)24-25-20(17)23-14-5-8-26(3)9-6-14/h4,7,10-11,14H,5-6,8-9H2,1-3H3,(H2,23,24,25)
InChIKeyBBEKIKINIZAJCH-UHFFFAOYSA-N
MW353.45 g/mol
LogP3.89
Rot. Bonds3

About 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine

6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine (PubChem CID 166631634) has the molecular formula C20H24FN5 and a molecular weight of 353.45 g/mol. Its IUPAC name is 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
PubChem CID166631634
Molecular FormulaC20H24FN5
Molecular Weight353.45 g/mol
Exact Mass353.20
IUPAC Name6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
SMILESCc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1ccnc(C)c1F
InChIInChI=1S/C20H24FN5/c1-12-10-17-18(11-16(12)15-4-7-22-13(2)19(15)21)24-25-20(17)23-14-5-8-26(3)9-6-14/h4,7,10-11,14H,5-6,8-9H2,1-3H3,(H2,23,24,25)
InChIKeyBBEKIKINIZAJCH-UHFFFAOYSA-N
XLogP3.89
TPSA56.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500353.45
LogP ≤ 53.89
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-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

Frequently Asked Questions

What is the IUPAC name of 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The IUPAC name of 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine (CID 166631634) is 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine.
What is the SMILES notation for 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The canonical SMILES for 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine is Cc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1ccnc(C)c1F.
What is the InChIKey of 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The InChIKey is BBEKIKINIZAJCH-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H24FN5/c1-12-10-17-18(11-16(12)15-4-7-22-13(2)19(15)21)24-25-20(17)23-14-5-8-26(3)9-6-14/h4,7,10-11,14H,5-6,8-9H2,1-3H3,(H2,23,24,25).
What are the key properties of 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine has a molecular weight of 353.45 g/mol, XLogP of 3.89, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(3-fluoro-2-methyl-4-pyridinyl)-5-methyl-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine is sourced from PubChem (CID 166631634), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).