3-ethyl-5H-naphtho[2,3-c]carbazole

C22H17N — CID 90260150

IUPAC3-ethyl-5H-naphtho[2,3-c]carbazole
SMILESCCc1ccc2c(c1)[nH]c1ccc3cc4ccccc4cc3c12
InChIInChI=1S/C22H17N/c1-2-14-7-9-18-21(11-14)23-20-10-8-17-12-15-5-3-4-6-16(15)13-19(17)22(18)20/h3-13,23H,2H2,1H3
InChIKeyVHHYZJSCVAXJLD-UHFFFAOYSA-N
MW295.38 g/mol
LogP6.19
Rot. Bonds1

About 3-ethyl-5H-naphtho[2,3-c]carbazole

3-ethyl-5H-naphtho[2,3-c]carbazole (PubChem CID 90260150) has the molecular formula C22H17N and a molecular weight of 295.38 g/mol. Its IUPAC name is 3-ethyl-5H-naphtho[2,3-c]carbazole.

Molecular Properties

Compound Name3-ethyl-5H-naphtho[2,3-c]carbazole
PubChem CID90260150
Molecular FormulaC22H17N
Molecular Weight295.38 g/mol
Exact Mass295.14
IUPAC Name3-ethyl-5H-naphtho[2,3-c]carbazole
SMILESCCc1ccc2c(c1)[nH]c1ccc3cc4ccccc4cc3c12
InChIInChI=1S/C22H17N/c1-2-14-7-9-18-21(11-14)23-20-10-8-17-12-15-5-3-4-6-16(15)13-19(17)22(18)20/h3-13,23H,2H2,1H3
InChIKeyVHHYZJSCVAXJLD-UHFFFAOYSA-N
XLogP6.19
TPSA15.79 Ų
H-Bond Donors1
H-Bond Acceptors
Rotatable Bonds1
Heavy Atoms23
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500295.38
LogP ≤ 56.19
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 100

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Polycyclic_aromatic_hydrocarbon_2', 'substructure': 'N/A'}

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Frequently Asked Questions

What is the IUPAC name of 3-ethyl-5H-naphtho[2,3-c]carbazole?
The IUPAC name of 3-ethyl-5H-naphtho[2,3-c]carbazole (CID 90260150) is 3-ethyl-5H-naphtho[2,3-c]carbazole.
What is the SMILES notation for 3-ethyl-5H-naphtho[2,3-c]carbazole?
The canonical SMILES for 3-ethyl-5H-naphtho[2,3-c]carbazole is CCc1ccc2c(c1)[nH]c1ccc3cc4ccccc4cc3c12.
What is the InChIKey of 3-ethyl-5H-naphtho[2,3-c]carbazole?
The InChIKey is VHHYZJSCVAXJLD-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H17N/c1-2-14-7-9-18-21(11-14)23-20-10-8-17-12-15-5-3-4-6-16(15)13-19(17)22(18)20/h3-13,23H,2H2,1H3.
What are the key properties of 3-ethyl-5H-naphtho[2,3-c]carbazole?
3-ethyl-5H-naphtho[2,3-c]carbazole has a molecular weight of 295.38 g/mol, XLogP of 6.19, 1 rotatable bonds, 1 hydrogen bond donors, and 0 hydrogen bond acceptors.
Where does this data come from?
All data for 3-ethyl-5H-naphtho[2,3-c]carbazole is sourced from PubChem (CID 90260150), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).