5-methoxy-2-pyrazol-1-yl-1H-indole

C12H11N3O — CID 66573122

IUPAC5-methoxy-2-pyrazol-1-yl-1H-indole
SMILESCOc1ccc2[nH]c(-n3cccn3)cc2c1
InChIInChI=1S/C12H11N3O/c1-16-10-3-4-11-9(7-10)8-12(14-11)15-6-2-5-13-15/h2-8,14H,1H3
InChIKeyQPRMNRJLWOBZLJ-UHFFFAOYSA-N
MW213.24 g/mol
LogP2.36
Rot. Bonds2

About 5-methoxy-2-pyrazol-1-yl-1H-indole

5-methoxy-2-pyrazol-1-yl-1H-indole (PubChem CID 66573122) has the molecular formula C12H11N3O and a molecular weight of 213.24 g/mol. Its IUPAC name is 5-methoxy-2-pyrazol-1-yl-1H-indole.

Molecular Properties

Compound Name5-methoxy-2-pyrazol-1-yl-1H-indole
PubChem CID66573122
Molecular FormulaC12H11N3O
Molecular Weight213.24 g/mol
Exact Mass213.09
IUPAC Name5-methoxy-2-pyrazol-1-yl-1H-indole
SMILESCOc1ccc2[nH]c(-n3cccn3)cc2c1
InChIInChI=1S/C12H11N3O/c1-16-10-3-4-11-9(7-10)8-12(14-11)15-6-2-5-13-15/h2-8,14H,1H3
InChIKeyQPRMNRJLWOBZLJ-UHFFFAOYSA-N
XLogP2.36
TPSA42.84 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500213.24
LogP ≤ 52.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-(1-(2,3-Dihydro-1-(4-methoxy-2-methylphenyl)-6-methyl-1H-pyrrolo(2,3-b)pyridin-4-yl)-1H-pyrazol-3-yl)-2-imidazolidinone
CID 11223423
6-(1H-indol-5-yloxy)-5-[(1E)-(methoxyimino)methyl]pyrimidin-4-amine
CID 23646047
5-Isopropoxy-3-(2-(4-methylpiperazin-1-yl)pyridin-4-yl)-1H-indazole
CID 90400782
1-(4-methoxyphenyl)-3-methyl-N-[(1S)-1-phenylethyl]-1H-pyrazolo[4,3-c]pyridin-6-amine
CID 25093249
6-(5-methoxy-1-methyl-1H-indol-3-yl)-5H-pyrrolo[2,3-b]pyrazine
CID 9860448
N',N'-diethyl-N-(8-methoxy-4,5-dimethylpyrido[4,3-b]indol-1-yl)propane-1,3-diamine
CID 183282
N'-(8-Methoxy-4,5-dimethyl-5H-pyrido(4,3-b) indol-1-yl)-N,N-dimethylpropanediamine
CID 183287
N',N'-diethyl-N-(8-methoxy-4-methyl-5H-pyrido[4,3-b]indol-1-yl)propane-1,3-diamine
CID 197233
3-[1-[1-(4-methoxy-2-methylphenyl)-6-methyl-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]-1H-imidazol-2-one
CID 11338604
1-[1-[1-(4-Methoxy-2-methylphenyl)-6-methyl-2,3-dihydropyrrolo[2,3-b]pyridin-4-yl]pyrazol-3-yl]-1,3-diazinan-2-one
CID 11983528
2-[1-(difluoromethyl)pyrazol-4-yl]-N-(2-methoxyphenyl)-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 66548653
N-(4-methoxyphenyl)-2-(1H-pyrazol-4-yl)-1H-pyrrolo[3,2-c]pyridin-6-amine
CID 68290849

Frequently Asked Questions

What is the IUPAC name of 5-methoxy-2-pyrazol-1-yl-1H-indole?
The IUPAC name of 5-methoxy-2-pyrazol-1-yl-1H-indole (CID 66573122) is 5-methoxy-2-pyrazol-1-yl-1H-indole.
What is the SMILES notation for 5-methoxy-2-pyrazol-1-yl-1H-indole?
The canonical SMILES for 5-methoxy-2-pyrazol-1-yl-1H-indole is COc1ccc2[nH]c(-n3cccn3)cc2c1.
What is the InChIKey of 5-methoxy-2-pyrazol-1-yl-1H-indole?
The InChIKey is QPRMNRJLWOBZLJ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H11N3O/c1-16-10-3-4-11-9(7-10)8-12(14-11)15-6-2-5-13-15/h2-8,14H,1H3.
What are the key properties of 5-methoxy-2-pyrazol-1-yl-1H-indole?
5-methoxy-2-pyrazol-1-yl-1H-indole has a molecular weight of 213.24 g/mol, XLogP of 2.36, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methoxy-2-pyrazol-1-yl-1H-indole is sourced from PubChem (CID 66573122), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).