5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole

C13H15N3O — CID 168941715

IUPAC5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole
SMILESCOc1ccc2[nH]nc(C3=CCCNC3)c2c1
InChIInChI=1S/C13H15N3O/c1-17-10-4-5-12-11(7-10)13(16-15-12)9-3-2-6-14-8-9/h3-5,7,14H,2,6,8H2,1H3,(H,15,16)
InChIKeyMHLPOBYDCKBGIB-UHFFFAOYSA-N
MW229.28 g/mol
LogP1.95
Rot. Bonds2

About 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole

5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole (PubChem CID 168941715) has the molecular formula C13H15N3O and a molecular weight of 229.28 g/mol. Its IUPAC name is 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole.

Molecular Properties

Compound Name5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole
PubChem CID168941715
Molecular FormulaC13H15N3O
Molecular Weight229.28 g/mol
Exact Mass229.12
IUPAC Name5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole
SMILESCOc1ccc2[nH]nc(C3=CCCNC3)c2c1
InChIInChI=1S/C13H15N3O/c1-17-10-4-5-12-11(7-10)13(16-15-12)9-3-2-6-14-8-9/h3-5,7,14H,2,6,8H2,1H3,(H,15,16)
InChIKeyMHLPOBYDCKBGIB-UHFFFAOYSA-N
XLogP1.95
TPSA49.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 51.95
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

5-Methoxy-1H-indazole
CID 13346860
4-(5-(4-Methoxyphenyl)-1H-pyrazol-3-yl)piperidine
CID 1486801
3-(3-Methoxyphenyl)-1H-Pyrazole
CID 2736766
3-(3-Methoxyphenyl)-5-(Trifluoromethyl)-1h-Pyrazole
CID 22352557
3-(4-Methoxyphenyl)-4,5,6,7-tetrahydro-1H-pyrazolo[4,3-c]pyridine
CID 28750454
5-(1-benzylpiperidin-4-yloxy)-1H-indazole
CID 44421888
3-(5-methoxy-1H-indazol-3-yl)benzenesulfonamide
CID 53476531
N-[4-(5-ethoxy-1H-indazol-3-yl)phenyl]acetamide
CID 71681990
Mps1 Inhibitor I
CID 73345836
5-(benzyloxy)-1H-indazole
CID 12798088
6-(1,3-dimethylindazol-5-yl)oxy-N-methyl-N-prop-2-enylhexan-1-amine
CID 44427946
N-[3-(5-ethoxy-1H-indazol-3-yl)phenyl]acetamide
CID 71681991

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole?
The IUPAC name of 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole (CID 168941715) is 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole.
What is the SMILES notation for 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole?
The canonical SMILES for 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole is COc1ccc2[nH]nc(C3=CCCNC3)c2c1.
What is the InChIKey of 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole?
The InChIKey is MHLPOBYDCKBGIB-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H15N3O/c1-17-10-4-5-12-11(7-10)13(16-15-12)9-3-2-6-14-8-9/h3-5,7,14H,2,6,8H2,1H3,(H,15,16).
What are the key properties of 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole?
5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole has a molecular weight of 229.28 g/mol, XLogP of 1.95, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-3-(1,2,3,6-tetrahydropyridin-5-yl)-1H-indazole is sourced from PubChem (CID 168941715), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).