7-phenylmethoxy-3-propan-2-yl-3H-indole

C18H19NO — CID 130325619

IUPAC7-phenylmethoxy-3-propan-2-yl-3H-indole
SMILESCC(C)C1C=Nc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C18H19NO/c1-13(2)16-11-19-18-15(16)9-6-10-17(18)20-12-14-7-4-3-5-8-14/h3-11,13,16H,12H2,1-2H3
InChIKeyGZUDXUJBUNYYAV-UHFFFAOYSA-N
MW265.36 g/mol
LogP4.72
Rot. Bonds4

About 7-phenylmethoxy-3-propan-2-yl-3H-indole

7-phenylmethoxy-3-propan-2-yl-3H-indole (PubChem CID 130325619) has the molecular formula C18H19NO and a molecular weight of 265.36 g/mol. Its IUPAC name is 7-phenylmethoxy-3-propan-2-yl-3H-indole.

Molecular Properties

Compound Name7-phenylmethoxy-3-propan-2-yl-3H-indole
PubChem CID130325619
Molecular FormulaC18H19NO
Molecular Weight265.36 g/mol
Exact Mass265.15
IUPAC Name7-phenylmethoxy-3-propan-2-yl-3H-indole
SMILESCC(C)C1C=Nc2c(OCc3ccccc3)cccc21
InChIInChI=1S/C18H19NO/c1-13(2)16-11-19-18-15(16)9-6-10-17(18)20-12-14-7-4-3-5-8-14/h3-11,13,16H,12H2,1-2H3
InChIKeyGZUDXUJBUNYYAV-UHFFFAOYSA-N
XLogP4.72
TPSA21.59 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500265.36
LogP ≤ 54.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

1-[2-[2-(2-hydroxypropyl)-3-phenylmethoxyphenyl]sulfanyl-6-phenylmethoxyphenyl]propan-2-ol
CID 70433050
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CID 89045446
1-(1-methoxyethoxy)-2-phenylmethoxybenzene
CID 22756308
ethane;methane;4-(2-phenylmethoxyphenyl)cyclohexan-1-ol
CID 163370228
(1aS,2S,7R,7aR)-3-phenylmethoxy-1a,2,7,7a-tetrahydronaphtho[2,3-b]oxirene-2,7-diol
CID 101352862
(1S)-1-(2-phenylmethoxyphenyl)ethanamine;hydrochloride
CID 71758033
(2-hydroxy-3-phenylmethoxyphenyl)methanediol
CID 155107233
1-methyl-3-phenylmethoxy-2-propan-2-yloxybenzene
CID 174337570
N-methyl-5-phenylmethoxy-1,2,3,4-tetrahydronaphthalen-1-amine
CID 65456122
2-bromo-6-phenylmethoxyphenol
CID 67346586
(1S)-1-(2-phenylmethoxyphenyl)propan-1-ol
CID 63365062
(1R)-1-(5-bromo-2-phenylmethoxyphenyl)ethanol
CID 78932268

Frequently Asked Questions

What is the IUPAC name of 7-phenylmethoxy-3-propan-2-yl-3H-indole?
The IUPAC name of 7-phenylmethoxy-3-propan-2-yl-3H-indole (CID 130325619) is 7-phenylmethoxy-3-propan-2-yl-3H-indole.
What is the SMILES notation for 7-phenylmethoxy-3-propan-2-yl-3H-indole?
The canonical SMILES for 7-phenylmethoxy-3-propan-2-yl-3H-indole is CC(C)C1C=Nc2c(OCc3ccccc3)cccc21.
What is the InChIKey of 7-phenylmethoxy-3-propan-2-yl-3H-indole?
The InChIKey is GZUDXUJBUNYYAV-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H19NO/c1-13(2)16-11-19-18-15(16)9-6-10-17(18)20-12-14-7-4-3-5-8-14/h3-11,13,16H,12H2,1-2H3.
What are the key properties of 7-phenylmethoxy-3-propan-2-yl-3H-indole?
7-phenylmethoxy-3-propan-2-yl-3H-indole has a molecular weight of 265.36 g/mol, XLogP of 4.72, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 7-phenylmethoxy-3-propan-2-yl-3H-indole is sourced from PubChem (CID 130325619), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).