1,2-dicyclopropyl-9H-carbazole

C18H17N — CID 152677747

IUPAC1,2-dicyclopropyl-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1c(C3CC3)c(C3CC3)ccc12
InChIInChI=1S/C18H17N/c1-2-4-16-14(3-1)15-10-9-13(11-5-6-11)17(12-7-8-12)18(15)19-16/h1-4,9-12,19H,5-8H2
InChIKeyZMWLALRRJXPCMG-UHFFFAOYSA-N
MW247.34 g/mol
LogP5.08
Rot. Bonds2

About 1,2-dicyclopropyl-9H-carbazole

1,2-dicyclopropyl-9H-carbazole (PubChem CID 152677747) has the molecular formula C18H17N and a molecular weight of 247.34 g/mol. Its IUPAC name is 1,2-dicyclopropyl-9H-carbazole.

Molecular Properties

Compound Name1,2-dicyclopropyl-9H-carbazole
PubChem CID152677747
Molecular FormulaC18H17N
Molecular Weight247.34 g/mol
Exact Mass247.14
IUPAC Name1,2-dicyclopropyl-9H-carbazole
SMILESc1ccc2c(c1)[nH]c1c(C3CC3)c(C3CC3)ccc12
InChIInChI=1S/C18H17N/c1-2-4-16-14(3-1)15-10-9-13(11-5-6-11)17(12-7-8-12)18(15)19-16/h1-4,9-12,19H,5-8H2
InChIKeyZMWLALRRJXPCMG-UHFFFAOYSA-N
XLogP5.08
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds2
Heavy Atoms19
Complexity

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500247.34
LogP ≤ 55.08
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

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Frequently Asked Questions

What is the IUPAC name of 1,2-dicyclopropyl-9H-carbazole?
The IUPAC name of 1,2-dicyclopropyl-9H-carbazole (CID 152677747) is 1,2-dicyclopropyl-9H-carbazole.
What is the SMILES notation for 1,2-dicyclopropyl-9H-carbazole?
The canonical SMILES for 1,2-dicyclopropyl-9H-carbazole is c1ccc2c(c1)[nH]c1c(C3CC3)c(C3CC3)ccc12.
What is the InChIKey of 1,2-dicyclopropyl-9H-carbazole?
The InChIKey is ZMWLALRRJXPCMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H17N/c1-2-4-16-14(3-1)15-10-9-13(11-5-6-11)17(12-7-8-12)18(15)19-16/h1-4,9-12,19H,5-8H2.
What are the key properties of 1,2-dicyclopropyl-9H-carbazole?
1,2-dicyclopropyl-9H-carbazole has a molecular weight of 247.34 g/mol, XLogP of 5.08, 2 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 1,2-dicyclopropyl-9H-carbazole is sourced from PubChem (CID 152677747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).