11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole

C20H22N2 — CID 15458747

IUPAC11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole
SMILESCCn1c2ccccc2c2ccc3c(c21)C(C)=CC(C)(C)N3
InChIInChI=1S/C20H22N2/c1-5-22-17-9-7-6-8-14(17)15-10-11-16-18(19(15)22)13(2)12-20(3,4)21-16/h6-12,21H,5H2,1-4H3
InChIKeyXIEIFFBKPGJSCW-UHFFFAOYSA-N
MW290.41 g/mol
LogP5.42
Rot. Bonds1

About 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole

11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole (PubChem CID 15458747) has the molecular formula C20H22N2 and a molecular weight of 290.41 g/mol. Its IUPAC name is 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole.

Molecular Properties

Compound Name11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole
PubChem CID15458747
Molecular FormulaC20H22N2
Molecular Weight290.41 g/mol
Exact Mass290.18
IUPAC Name11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole
SMILESCCn1c2ccccc2c2ccc3c(c21)C(C)=CC(C)(C)N3
InChIInChI=1S/C20H22N2/c1-5-22-17-9-7-6-8-14(17)15-10-11-16-18(19(15)22)13(2)12-20(3,4)21-16/h6-12,21H,5H2,1-4H3
InChIKeyXIEIFFBKPGJSCW-UHFFFAOYSA-N
XLogP5.42
TPSA16.96 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

1 violation

RuleValue
MW ≤ 500290.41
LogP ≤ 55.42
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 14710
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Iprindole
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Rimcazole
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3-Amino-9-ethylcarbazole
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Mebhydrolin
CID 22530
Pirlindole
CID 68802
LE-300
CID 4350931
Avn-101
CID 42631003
N-ethyl carbazole
CID 6836

Frequently Asked Questions

What is the IUPAC name of 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole?
The IUPAC name of 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole (CID 15458747) is 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole.
What is the SMILES notation for 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole?
The canonical SMILES for 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole is CCn1c2ccccc2c2ccc3c(c21)C(C)=CC(C)(C)N3.
What is the InChIKey of 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole?
The InChIKey is XIEIFFBKPGJSCW-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H22N2/c1-5-22-17-9-7-6-8-14(17)15-10-11-16-18(19(15)22)13(2)12-20(3,4)21-16/h6-12,21H,5H2,1-4H3.
What are the key properties of 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole?
11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole has a molecular weight of 290.41 g/mol, XLogP of 5.42, 1 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-ethyl-1,3,3-trimethyl-4H-pyrido[3,2-a]carbazole is sourced from PubChem (CID 15458747), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).