9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole

C17H17NO2 — CID 3769030

IUPAC9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole
SMILESCC1COC(Cn2c3ccccc3c3ccccc32)O1
InChIInChI=1S/C17H17NO2/c1-12-11-19-17(20-12)10-18-15-8-4-2-6-13(15)14-7-3-5-9-16(14)18/h2-9,12,17H,10-11H2,1H3
InChIKeyAFHSKLXOUIJSRM-UHFFFAOYSA-N
MW267.33 g/mol
LogP3.56
Rot. Bonds2

About 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole

9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole (PubChem CID 3769030) has the molecular formula C17H17NO2 and a molecular weight of 267.33 g/mol. Its IUPAC name is 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole.

Molecular Properties

Compound Name9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole
PubChem CID3769030
Molecular FormulaC17H17NO2
Molecular Weight267.33 g/mol
Exact Mass267.13
IUPAC Name9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole
SMILESCC1COC(Cn2c3ccccc3c3ccccc32)O1
InChIInChI=1S/C17H17NO2/c1-12-11-19-17(20-12)10-18-15-8-4-2-6-13(15)14-7-3-5-9-16(14)18/h2-9,12,17H,10-11H2,1H3
InChIKeyAFHSKLXOUIJSRM-UHFFFAOYSA-N
XLogP3.56
TPSA23.39 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.33
LogP ≤ 53.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole?
The IUPAC name of 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole (CID 3769030) is 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole.
What is the SMILES notation for 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole?
The canonical SMILES for 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole is CC1COC(Cn2c3ccccc3c3ccccc32)O1.
What is the InChIKey of 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole?
The InChIKey is AFHSKLXOUIJSRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H17NO2/c1-12-11-19-17(20-12)10-18-15-8-4-2-6-13(15)14-7-3-5-9-16(14)18/h2-9,12,17H,10-11H2,1H3.
What are the key properties of 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole?
9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole has a molecular weight of 267.33 g/mol, XLogP of 3.56, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-[(4-methyl-1,3-dioxolan-2-yl)methyl]carbazole is sourced from PubChem (CID 3769030), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).