1-methyl-4-phenylmethoxyindazole

C15H14N2O — CID 143030970

IUPAC1-methyl-4-phenylmethoxyindazole
SMILESCn1ncc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C15H14N2O/c1-17-14-8-5-9-15(13(14)10-16-17)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3
InChIKeyRUTFDHMTYJAFRR-UHFFFAOYSA-N
MW238.29 g/mol
LogP3.15
Rot. Bonds3

About 1-methyl-4-phenylmethoxyindazole

1-methyl-4-phenylmethoxyindazole (PubChem CID 143030970) has the molecular formula C15H14N2O and a molecular weight of 238.29 g/mol. Its IUPAC name is 1-methyl-4-phenylmethoxyindazole.

Molecular Properties

Compound Name1-methyl-4-phenylmethoxyindazole
PubChem CID143030970
Molecular FormulaC15H14N2O
Molecular Weight238.29 g/mol
Exact Mass238.11
IUPAC Name1-methyl-4-phenylmethoxyindazole
SMILESCn1ncc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C15H14N2O/c1-17-14-8-5-9-15(13(14)10-16-17)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3
InChIKeyRUTFDHMTYJAFRR-UHFFFAOYSA-N
XLogP3.15
TPSA27.05 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500238.29
LogP ≤ 53.15
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

1-(3-chloro-4-methoxyphenyl)-4-phenylmethoxyindazole
CID 59272957
1-ethyl-4-phenylmethoxyindole
CID 24776902
1-methyl-4-phenylmethoxybenzimidazol-2-amine
CID 144791590
1-ethyl-2-methyl-4-phenylmethoxyindole
CID 143459562
N,N-dimethyl-3-(4-phenylmethoxyindol-1-yl)propan-1-amine
CID 84571792
1-(bromomethyl)-4-phenylmethoxyindole
CID 59096925
1,3-dimethyl-4-phenylmethoxybenzimidazol-2-one
CID 70827960
N-benzyl-N-[2-chloro-2-(1-methylindazol-4-yl)ethyl]-4-oxo-5-phenylmethoxy-1H-pyridazine-3-carboxamide
CID 177223470
1-(1-phenylethyl)-4-phenylmethoxyindole
CID 84571178
1-(2-naphthalen-1-yloxyethyl)-4-phenylmethoxyindole
CID 84571556
CID 59096793
CID 59096793
2-cyclopropyl-1-methyl-4-phenylmethoxybenzimidazole
CID 141096815

Frequently Asked Questions

What is the IUPAC name of 1-methyl-4-phenylmethoxyindazole?
The IUPAC name of 1-methyl-4-phenylmethoxyindazole (CID 143030970) is 1-methyl-4-phenylmethoxyindazole.
What is the SMILES notation for 1-methyl-4-phenylmethoxyindazole?
The canonical SMILES for 1-methyl-4-phenylmethoxyindazole is Cn1ncc2c(OCc3ccccc3)cccc21.
What is the InChIKey of 1-methyl-4-phenylmethoxyindazole?
The InChIKey is RUTFDHMTYJAFRR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H14N2O/c1-17-14-8-5-9-15(13(14)10-16-17)18-11-12-6-3-2-4-7-12/h2-10H,11H2,1H3.
What are the key properties of 1-methyl-4-phenylmethoxyindazole?
1-methyl-4-phenylmethoxyindazole has a molecular weight of 238.29 g/mol, XLogP of 3.15, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-methyl-4-phenylmethoxyindazole is sourced from PubChem (CID 143030970), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).