6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine

C21H27N5O — CID 166627496

IUPAC6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
SMILESCOc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1cc(C)nc(C)c1
InChIInChI=1S/C21H27N5O/c1-13-9-15(10-14(2)22-13)17-11-19-18(12-20(17)27-4)21(25-24-19)23-16-5-7-26(3)8-6-16/h9-12,16H,5-8H2,1-4H3,(H2,23,24,25)
InChIKeySFFOUDBTVHJYOG-UHFFFAOYSA-N
MW365.48 g/mol
LogP3.76
Rot. Bonds4

About 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine

6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine (PubChem CID 166627496) has the molecular formula C21H27N5O and a molecular weight of 365.48 g/mol. Its IUPAC name is 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine.

Molecular Properties

Compound Name6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
PubChem CID166627496
Molecular FormulaC21H27N5O
Molecular Weight365.48 g/mol
Exact Mass365.22
IUPAC Name6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
SMILESCOc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1cc(C)nc(C)c1
InChIInChI=1S/C21H27N5O/c1-13-9-15(10-14(2)22-13)17-11-19-18(12-20(17)27-4)21(25-24-19)23-16-5-7-26(3)8-6-16/h9-12,16H,5-8H2,1-4H3,(H2,23,24,25)
InChIKeySFFOUDBTVHJYOG-UHFFFAOYSA-N
XLogP3.76
TPSA66.07 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500365.48
LogP ≤ 53.76
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

Analyze 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-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

Related Compounds

6-Methoxy-3,8-Dimethyl-4-(Morpholin-4-Ylmethyl)-1h-Pyrazolo[3,4-B]quinoline
CID 44243146
6-Methoxy-3,8-Dimethyl-4-(Piperazin-1-Yl)-1h-Pyrazolo[3,4-B]quinoline
CID 46239840
1-(6-methoxy-3,8-dimethyl-2H-pyrazolo[3,4-b]quinolin-4-yl)piperidin-4-amine
CID 46239329
[1-(6-methoxy-3,8-dimethyl-2H-pyrazolo[3,4-b]quinolin-4-yl)piperidin-4-yl]methanamine
CID 57393964
6-(3-fluoro-2-methyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine
CID 166635576
6-(2-Amino-4-pyrimidinyl)-4-(methyloxy)-1H-indazol-3-amine
CID 46214313
6-{2-amino-6-[(3R)-3-ethyl-4-morpholinyl]-4-pyrimidinyl}-4-(methyloxy)-1H-indazol-3-amine
CID 58504384
N-(1-((1H-indazol-6-yl)methyl)piperidin-4-yl)-5-methoxy-1H-indazol-3-amine
CID 44405408
6-methoxy-3,8-dimethyl-4-[(3S)-3-methylpiperazin-1-yl]-2H-pyrazolo[3,4-b]quinoline
CID 46238926
6-methoxy-3,8-dimethyl-N-(piperidin-4-ylmethyl)-2H-pyrazolo[3,4-b]quinolin-4-amine
CID 46239123
6-methoxy-3,8-dimethyl-N-[2-(oxan-4-yl)ethyl]-2H-pyrazolo[3,4-b]quinolin-4-amine
CID 46239126
4-[(4-fluoropiperidin-1-yl)methyl]-6-methoxy-3,8-dimethyl-2H-pyrazolo[3,4-b]quinoline
CID 46239331

Frequently Asked Questions

What is the IUPAC name of 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The IUPAC name of 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine (CID 166627496) is 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine.
What is the SMILES notation for 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The canonical SMILES for 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine is COc1cc2c(NC3CCN(C)CC3)n[nH]c2cc1-c1cc(C)nc(C)c1.
What is the InChIKey of 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
The InChIKey is SFFOUDBTVHJYOG-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H27N5O/c1-13-9-15(10-14(2)22-13)17-11-19-18(12-20(17)27-4)21(25-24-19)23-16-5-7-26(3)8-6-16/h9-12,16H,5-8H2,1-4H3,(H2,23,24,25).
What are the key properties of 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine?
6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine has a molecular weight of 365.48 g/mol, XLogP of 3.76, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 6-(2,6-dimethyl-4-pyridinyl)-5-methoxy-N-(1-methylpiperidin-4-yl)-1H-indazol-3-amine is sourced from PubChem (CID 166627496), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).