9-(1-propan-2-yloxypropyl)carbazole

C18H21NO — CID 5132879

IUPAC9-(1-propan-2-yloxypropyl)carbazole
SMILESCCC(OC(C)C)n1c2ccccc2c2ccccc21
InChIInChI=1S/C18H21NO/c1-4-18(20-13(2)3)19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h5-13,18H,4H2,1-3H3
InChIKeyCNGNHNRSFJDETB-UHFFFAOYSA-N
MW267.37 g/mol
LogP5.13
Rot. Bonds4

About 9-(1-propan-2-yloxypropyl)carbazole

9-(1-propan-2-yloxypropyl)carbazole (PubChem CID 5132879) has the molecular formula C18H21NO and a molecular weight of 267.37 g/mol. Its IUPAC name is 9-(1-propan-2-yloxypropyl)carbazole.

Molecular Properties

Compound Name9-(1-propan-2-yloxypropyl)carbazole
PubChem CID5132879
Molecular FormulaC18H21NO
Molecular Weight267.37 g/mol
Exact Mass267.16
IUPAC Name9-(1-propan-2-yloxypropyl)carbazole
SMILESCCC(OC(C)C)n1c2ccccc2c2ccccc21
InChIInChI=1S/C18H21NO/c1-4-18(20-13(2)3)19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h5-13,18H,4H2,1-3H3
InChIKeyCNGNHNRSFJDETB-UHFFFAOYSA-N
XLogP5.13
TPSA14.16 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500267.37
LogP ≤ 55.13
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Frequently Asked Questions

What is the IUPAC name of 9-(1-propan-2-yloxypropyl)carbazole?
The IUPAC name of 9-(1-propan-2-yloxypropyl)carbazole (CID 5132879) is 9-(1-propan-2-yloxypropyl)carbazole.
What is the SMILES notation for 9-(1-propan-2-yloxypropyl)carbazole?
The canonical SMILES for 9-(1-propan-2-yloxypropyl)carbazole is CCC(OC(C)C)n1c2ccccc2c2ccccc21.
What is the InChIKey of 9-(1-propan-2-yloxypropyl)carbazole?
The InChIKey is CNGNHNRSFJDETB-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H21NO/c1-4-18(20-13(2)3)19-16-11-7-5-9-14(16)15-10-6-8-12-17(15)19/h5-13,18H,4H2,1-3H3.
What are the key properties of 9-(1-propan-2-yloxypropyl)carbazole?
9-(1-propan-2-yloxypropyl)carbazole has a molecular weight of 267.37 g/mol, XLogP of 5.13, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 9-(1-propan-2-yloxypropyl)carbazole is sourced from PubChem (CID 5132879), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).