3-(5-methyl-1H-indol-2-yl)-1H-indazole

C16H13N3 — CID 135494486

IUPAC3-(5-methyl-1H-indol-2-yl)-1H-indazole
SMILESCc1ccc2[nH]c(-c3n[nH]c4ccccc34)cc2c1
InChIInChI=1S/C16H13N3/c1-10-6-7-13-11(8-10)9-15(17-13)16-12-4-2-3-5-14(12)18-19-16/h2-9,17H,1H3,(H,18,19)
InChIKeyTWCBDFOBFWDISE-UHFFFAOYSA-N
MW247.30 g/mol
LogP4.02
Rot. Bonds1

About 3-(5-methyl-1H-indol-2-yl)-1H-indazole

3-(5-methyl-1H-indol-2-yl)-1H-indazole (PubChem CID 135494486) has the molecular formula C16H13N3 and a molecular weight of 247.30 g/mol. Its IUPAC name is 3-(5-methyl-1H-indol-2-yl)-1H-indazole.

Molecular Properties

Compound Name3-(5-methyl-1H-indol-2-yl)-1H-indazole
PubChem CID135494486
Molecular FormulaC16H13N3
Molecular Weight247.30 g/mol
Exact Mass247.11
IUPAC Name3-(5-methyl-1H-indol-2-yl)-1H-indazole
SMILESCc1ccc2[nH]c(-c3n[nH]c4ccccc34)cc2c1
InChIInChI=1S/C16H13N3/c1-10-6-7-13-11(8-10)9-15(17-13)16-12-4-2-3-5-14(12)18-19-16/h2-9,17H,1H3,(H,18,19)
InChIKeyTWCBDFOBFWDISE-UHFFFAOYSA-N
XLogP4.02
TPSA44.47 Ų
H-Bond Donors2
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.30
LogP ≤ 54.02
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 101

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Related Compounds

3-Methylcarbazole
CID 20746
[5-(3-{5-[(4-fluoropiperidin-1-yl)methyl]-1H-indol-2-yl}-1H-indazol-6-yl)-1H-1,2,3-triazol-4-yl]methanamine
CID 135438541
3-(5-((4-(aminomethyl)piperidin-1-yl)methyl)-1H-indol-2-yl)-1H-indazole-6-carbonitrile
CID 135525556
2,4,5,10-Tetrahydropyrazolo[3,4-a]carbazole
CID 645436
4,5,6,11-Tetrahydro-1h-Pyrazolo[4',3':6,7]cyclohepta[1,2-B]indole
CID 135566619
1H-Indole, 5-methyl-2-phenyl-
CID 83247
Phenyl-(3-phenyl-1H-indazol-6-yl)-amine
CID 10236389
3-(1H-indol-2-yl)-6-(1H-1,2,3,4-tetrazol-5-yl)-1H-indazole
CID 135418209
1-(4-{[2-(1H-indazol-3-yl)-1H-indol-5-yl]methyl}piperazin-1-yl)ethan-1-one
CID 135559055
3-[5-(Piperidin-1-ylmethyl)-1h-indol-2-yl]-6-(1h-1,2,3-triazol-1-yl)-1h-indazole
CID 135559064
3-[5-(Piperidin-1-ylmethyl)-1h-indol-2-yl]-6-(2h-1,2,3-triazol-2-yl)-1h-indazole
CID 135559067
6-Phenyl-3-[5-(piperidin-1-ylmethyl)-1h-indol-2-yl]-1h-indazole
CID 135559068

Frequently Asked Questions

What is the IUPAC name of 3-(5-methyl-1H-indol-2-yl)-1H-indazole?
The IUPAC name of 3-(5-methyl-1H-indol-2-yl)-1H-indazole (CID 135494486) is 3-(5-methyl-1H-indol-2-yl)-1H-indazole.
What is the SMILES notation for 3-(5-methyl-1H-indol-2-yl)-1H-indazole?
The canonical SMILES for 3-(5-methyl-1H-indol-2-yl)-1H-indazole is Cc1ccc2[nH]c(-c3n[nH]c4ccccc34)cc2c1.
What is the InChIKey of 3-(5-methyl-1H-indol-2-yl)-1H-indazole?
The InChIKey is TWCBDFOBFWDISE-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H13N3/c1-10-6-7-13-11(8-10)9-15(17-13)16-12-4-2-3-5-14(12)18-19-16/h2-9,17H,1H3,(H,18,19).
What are the key properties of 3-(5-methyl-1H-indol-2-yl)-1H-indazole?
3-(5-methyl-1H-indol-2-yl)-1H-indazole has a molecular weight of 247.30 g/mol, XLogP of 4.02, 1 rotatable bonds, 2 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-(5-methyl-1H-indol-2-yl)-1H-indazole is sourced from PubChem (CID 135494486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).