1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone

C18H14N2O2 — CID 12664561

IUPAC1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone
SMILESCC(=O)c1c[nH]c2ccc3c(c4ccccc4n3C(C)=O)c12
InChIInChI=1S/C18H14N2O2/c1-10(21)13-9-19-14-7-8-16-18(17(13)14)12-5-3-4-6-15(12)20(16)11(2)22/h3-9,19H,1-2H3
InChIKeyIQBAGIJKGMSCPD-UHFFFAOYSA-N
MW290.32 g/mol
LogP4.14
Rot. Bonds1

About 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone

1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone (PubChem CID 12664561) has the molecular formula C18H14N2O2 and a molecular weight of 290.32 g/mol. Its IUPAC name is 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone.

Molecular Properties

Compound Name1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone
PubChem CID12664561
Molecular FormulaC18H14N2O2
Molecular Weight290.32 g/mol
Exact Mass290.11
IUPAC Name1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone
SMILESCC(=O)c1c[nH]c2ccc3c(c4ccccc4n3C(C)=O)c12
InChIInChI=1S/C18H14N2O2/c1-10(21)13-9-19-14-7-8-16-18(17(13)14)12-5-3-4-6-15(12)20(16)11(2)22/h3-9,19H,1-2H3
InChIKeyIQBAGIJKGMSCPD-UHFFFAOYSA-N
XLogP4.14
TPSA54.86 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.32
LogP ≤ 54.14
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

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CID 170857784
1-carbazol-9-ylethanone;ethane
CID 142183368
1-carbazol-9-ylethanone;diaziridin-3-one
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1-(4,5-dimethyl-1H-indol-3-yl)ethanone
CID 82405420
1-(3-carbazol-9-ylcarbazol-9-yl)ethanone
CID 118391781
1-[2,7-bis(1H-indol-3-yl)carbazol-9-yl]ethanone
CID 174779450
N-(9-acetylcarbazol-3-yl)acetamide
CID 3326945
ethane;1-(1H-indol-3-yl)propane-1,2-dione
CID 90885148
1H-indole-3-carbaldehyde;1-indol-1-ylethanone;1-(1H-indol-3-yl)ethanone
CID 174483590
1-[5-(dimethylamino)-1H-indol-3-yl]ethanone
CID 82397112
1-[2-(hydroxymethyl)-3-iodoindol-1-yl]ethanone
CID 133055461
(1,2-diacetylindol-3-yl) acetate
CID 31196222

Frequently Asked Questions

What is the IUPAC name of 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone?
The IUPAC name of 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone (CID 12664561) is 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone.
What is the SMILES notation for 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone?
The canonical SMILES for 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone is CC(=O)c1c[nH]c2ccc3c(c4ccccc4n3C(C)=O)c12.
What is the InChIKey of 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone?
The InChIKey is IQBAGIJKGMSCPD-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H14N2O2/c1-10(21)13-9-19-14-7-8-16-18(17(13)14)12-5-3-4-6-15(12)20(16)11(2)22/h3-9,19H,1-2H3.
What are the key properties of 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone?
1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone has a molecular weight of 290.32 g/mol, XLogP of 4.14, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(6-acetyl-3H-pyrrolo[2,3-c]carbazol-1-yl)ethanone is sourced from PubChem (CID 12664561), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).