2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol

C14H17N3O2 — CID 114638224

IUPAC2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol
SMILESCOc1cnn(C)c1C(O)c1cccc2c1NCC2
InChIInChI=1S/C14H17N3O2/c1-17-13(11(19-2)8-16-17)14(18)10-5-3-4-9-6-7-15-12(9)10/h3-5,8,14-15,18H,6-7H2,1-2H3
InChIKeyHGBYGPJDKFVEOZ-UHFFFAOYSA-N
MW259.31 g/mol
LogP1.48
Rot. Bonds3

About 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol

2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol (PubChem CID 114638224) has the molecular formula C14H17N3O2 and a molecular weight of 259.31 g/mol. Its IUPAC name is 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol.

Molecular Properties

Compound Name2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol
PubChem CID114638224
Molecular FormulaC14H17N3O2
Molecular Weight259.31 g/mol
Exact Mass259.13
IUPAC Name2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol
SMILESCOc1cnn(C)c1C(O)c1cccc2c1NCC2
InChIInChI=1S/C14H17N3O2/c1-17-13(11(19-2)8-16-17)14(18)10-5-3-4-9-6-7-15-12(9)10/h3-5,8,14-15,18H,6-7H2,1-2H3
InChIKeyHGBYGPJDKFVEOZ-UHFFFAOYSA-N
XLogP1.48
TPSA59.31 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500259.31
LogP ≤ 51.48
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

(4-chloro-1-methylpyrazol-5-yl)-(2,3-dihydro-1H-indol-7-yl)methanol
CID 114638231
7-[fluoro-(4-methoxy-1-propan-2-ylpyrazol-5-yl)methyl]-2,3-dihydro-1H-indole
CID 114667952
(2,3-dimethoxyphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114634621
[4-bromo-1-(2-methoxyethyl)pyrazol-5-yl]-(2,3-dihydro-1H-indol-7-yl)methanol
CID 114638223
(2-chlorophenyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114634561
[2-fluoro-3-(trifluoromethyl)phenyl]-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114644854
(2-methoxy-5-methylphenyl)-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 115836879
2,3-dihydro-1H-indol-7-yl-(2-methoxy-4,6-dimethylphenyl)methanol
CID 106679754
(4-methoxy-1-methylpyrazol-5-yl)-thiophen-2-ylmethanol
CID 114634516
3-[hydroxy-(4-methoxy-1-methylpyrazol-5-yl)methyl]benzonitrile
CID 114637573
[4-(difluoromethoxy)phenyl]-(4-methoxy-1-methylpyrazol-5-yl)methanol
CID 114634220
1-(2,3-dihydro-1H-indol-7-yl)-3-(1-methylpyrazol-4-yl)propan-1-ol
CID 103006799

Frequently Asked Questions

What is the IUPAC name of 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The IUPAC name of 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol (CID 114638224) is 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol.
What is the SMILES notation for 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The canonical SMILES for 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol is COc1cnn(C)c1C(O)c1cccc2c1NCC2.
What is the InChIKey of 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol?
The InChIKey is HGBYGPJDKFVEOZ-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17N3O2/c1-17-13(11(19-2)8-16-17)14(18)10-5-3-4-9-6-7-15-12(9)10/h3-5,8,14-15,18H,6-7H2,1-2H3.
What are the key properties of 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol?
2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol has a molecular weight of 259.31 g/mol, XLogP of 1.48, 3 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 2,3-dihydro-1H-indol-7-yl-(4-methoxy-1-methylpyrazol-5-yl)methanol is sourced from PubChem (CID 114638224), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).