3-methyl-1-phenylmethoxy-9H-carbazole

C20H17NO — CID 15432469

IUPAC3-methyl-1-phenylmethoxy-9H-carbazole
SMILESCc1cc(OCc2ccccc2)c2[nH]c3ccccc3c2c1
InChIInChI=1S/C20H17NO/c1-14-11-17-16-9-5-6-10-18(16)21-20(17)19(12-14)22-13-15-7-3-2-4-8-15/h2-12,21H,13H2,1H3
InChIKeyDAMGHNFUNZJQDS-UHFFFAOYSA-N
MW287.36 g/mol
LogP5.21
Rot. Bonds3

About 3-methyl-1-phenylmethoxy-9H-carbazole

3-methyl-1-phenylmethoxy-9H-carbazole (PubChem CID 15432469) has the molecular formula C20H17NO and a molecular weight of 287.36 g/mol. Its IUPAC name is 3-methyl-1-phenylmethoxy-9H-carbazole.

Molecular Properties

Compound Name3-methyl-1-phenylmethoxy-9H-carbazole
PubChem CID15432469
Molecular FormulaC20H17NO
Molecular Weight287.36 g/mol
Exact Mass287.13
IUPAC Name3-methyl-1-phenylmethoxy-9H-carbazole
SMILESCc1cc(OCc2ccccc2)c2[nH]c3ccccc3c2c1
InChIInChI=1S/C20H17NO/c1-14-11-17-16-9-5-6-10-18(16)21-20(17)19(12-14)22-13-15-7-3-2-4-8-15/h2-12,21H,13H2,1H3
InChIKeyDAMGHNFUNZJQDS-UHFFFAOYSA-N
XLogP5.21
TPSA25.02 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds3
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500287.36
LogP ≤ 55.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 3-methyl-1-phenylmethoxy-9H-carbazole?
The IUPAC name of 3-methyl-1-phenylmethoxy-9H-carbazole (CID 15432469) is 3-methyl-1-phenylmethoxy-9H-carbazole.
What is the SMILES notation for 3-methyl-1-phenylmethoxy-9H-carbazole?
The canonical SMILES for 3-methyl-1-phenylmethoxy-9H-carbazole is Cc1cc(OCc2ccccc2)c2[nH]c3ccccc3c2c1.
What is the InChIKey of 3-methyl-1-phenylmethoxy-9H-carbazole?
The InChIKey is DAMGHNFUNZJQDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H17NO/c1-14-11-17-16-9-5-6-10-18(16)21-20(17)19(12-14)22-13-15-7-3-2-4-8-15/h2-12,21H,13H2,1H3.
What are the key properties of 3-methyl-1-phenylmethoxy-9H-carbazole?
3-methyl-1-phenylmethoxy-9H-carbazole has a molecular weight of 287.36 g/mol, XLogP of 5.21, 3 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 3-methyl-1-phenylmethoxy-9H-carbazole is sourced from PubChem (CID 15432469), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).