7-methyl-5-phenylmethoxy-1H-indole

C32H30N2O2 — CID 156694720

IUPAC7-methyl-5-phenylmethoxy-1H-indole
SMILESCc1cc(OCc2ccccc2)cc2cc[nH]c12.Cc1cc(OCc2ccccc2)cc2cc[nH]c12
InChIInChI=1S/2C16H15NO/c2*1-12-9-15(10-14-7-8-17-16(12)14)18-11-13-5-3-2-4-6-13/h2*2-10,17H,11H2,1H3
InChIKeyGXIBTAHMNBCUIJ-UHFFFAOYSA-N
MW474.60 g/mol
LogP8.11
Rot. Bonds6

About 7-methyl-5-phenylmethoxy-1H-indole

7-methyl-5-phenylmethoxy-1H-indole (PubChem CID 156694720) has the molecular formula C32H30N2O2 and a molecular weight of 474.60 g/mol. Its IUPAC name is 7-methyl-5-phenylmethoxy-1H-indole.

Molecular Properties

Compound Name7-methyl-5-phenylmethoxy-1H-indole
PubChem CID156694720
Molecular FormulaC32H30N2O2
Molecular Weight474.60 g/mol
Exact Mass474.23
IUPAC Name7-methyl-5-phenylmethoxy-1H-indole
SMILESCc1cc(OCc2ccccc2)cc2cc[nH]c12.Cc1cc(OCc2ccccc2)cc2cc[nH]c12
InChIInChI=1S/2C16H15NO/c2*1-12-9-15(10-14-7-8-17-16(12)14)18-11-13-5-3-2-4-6-13/h2*2-10,17H,11H2,1H3
InChIKeyGXIBTAHMNBCUIJ-UHFFFAOYSA-N
XLogP8.11
TPSA50.04 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms36
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500474.60
LogP ≤ 58.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

Analyze 7-methyl-5-phenylmethoxy-1H-indole with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

8-methoxy-6-phenylmethoxy-1H-quinolin-4-one
CID 15675252
2-methyl-4,6-bis(phenylmethoxy)phenol
CID 11301646
4-bromo-5-methyl-7-phenylmethoxy-1H-indole
CID 59898831
1,3-bis[[3,5-bis[[3,5-bis[[3,5-bis(phenylmethoxy)phenyl]methoxy]phenyl]methoxy]phenyl]methoxy]-5-methylbenzene
CID 102395902
2-methyl-4-phenylmethoxybenzenethiol
CID 142266616
1-iodo-3,5-bis(phenylmethoxy)benzene
CID 15389195
2-methyl-7-phenylmethoxynaphthalene
CID 90146760
1,7-dimethyl-5-phenylmethoxyindole-2-carboxylic acid
CID 145364314
1,3-difluoro-2-methyl-5-phenylmethoxybenzene;ethane
CID 142106571
2-ethenyl-6-methyl-4-phenylmethoxyaniline
CID 143575474
2-[(4-chlorophenyl)methyl]-1,3-dimethyl-5-phenylmethoxybenzene
CID 68866864
2-methyl-4,6-bis(phenylmethoxy)benzaldehyde
CID 11359497

Frequently Asked Questions

What is the IUPAC name of 7-methyl-5-phenylmethoxy-1H-indole?
The IUPAC name of 7-methyl-5-phenylmethoxy-1H-indole (CID 156694720) is 7-methyl-5-phenylmethoxy-1H-indole.
What is the SMILES notation for 7-methyl-5-phenylmethoxy-1H-indole?
The canonical SMILES for 7-methyl-5-phenylmethoxy-1H-indole is Cc1cc(OCc2ccccc2)cc2cc[nH]c12.Cc1cc(OCc2ccccc2)cc2cc[nH]c12.
What is the InChIKey of 7-methyl-5-phenylmethoxy-1H-indole?
The InChIKey is GXIBTAHMNBCUIJ-UHFFFAOYSA-N. The full InChI is InChI=1S/2C16H15NO/c2*1-12-9-15(10-14-7-8-17-16(12)14)18-11-13-5-3-2-4-6-13/h2*2-10,17H,11H2,1H3.
What are the key properties of 7-methyl-5-phenylmethoxy-1H-indole?
7-methyl-5-phenylmethoxy-1H-indole has a molecular weight of 474.60 g/mol, XLogP of 8.11, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-methyl-5-phenylmethoxy-1H-indole is sourced from PubChem (CID 156694720), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).