9-(phenylmethoxymethyl)carbazole

C20H17NO — CID 2227531

IUPAC9-(phenylmethoxymethyl)carbazole
SMILESc1ccc(COCn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C20H17NO/c1-2-8-16(9-3-1)14-22-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13H,14-15H2
InChIKeyXTRWHYJFWDUWGL-UHFFFAOYSA-N
MW287.36 g/mol
LogP4.97
Rot. Bonds4

About 9-(phenylmethoxymethyl)carbazole

9-(phenylmethoxymethyl)carbazole (PubChem CID 2227531) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is 9-(phenylmethoxymethyl)carbazole.

Molecular Properties

Compound Name9-(phenylmethoxymethyl)carbazole
PubChem CID2227531
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name9-(phenylmethoxymethyl)carbazole
SMILESc1ccc(COCn2c3ccccc3c3ccccc32)cc1
InChIInChI=1S/C20H17NO/c1-2-8-16(9-3-1)14-22-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13H,14-15H2
InChIKeyXTRWHYJFWDUWGL-UHFFFAOYSA-N
XLogP4.97
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500287.36
LogP ≤ 54.97
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 122502701
9-[[3-(carbazol-9-ylmethyl)phenyl]methyl]carbazole
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4,5-dibromo-2-chloro-1-(phenylmethoxymethyl)imidazole
CID 25215098
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Frequently Asked Questions

What is the IUPAC name of 9-(phenylmethoxymethyl)carbazole?
The IUPAC name of 9-(phenylmethoxymethyl)carbazole (CID 2227531) is 9-(phenylmethoxymethyl)carbazole.
What is the SMILES notation for 9-(phenylmethoxymethyl)carbazole?
The canonical SMILES for 9-(phenylmethoxymethyl)carbazole is c1ccc(COCn2c3ccccc3c3ccccc32)cc1.
What is the InChIKey of 9-(phenylmethoxymethyl)carbazole?
The InChIKey is XTRWHYJFWDUWGL-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-2-8-16(9-3-1)14-22-15-21-19-12-6-4-10-17(19)18-11-5-7-13-20(18)21/h1-13H,14-15H2.
What are the key properties of 9-(phenylmethoxymethyl)carbazole?
9-(phenylmethoxymethyl)carbazole has a molecular weight of 287.36 g/mol, XLogP of 4.97, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(phenylmethoxymethyl)carbazole is sourced from PubChem (CID 2227531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).