carbazol-9-yl(imidazol-1-yl)methanone

C16H11N3O — CID 164739630

IUPACcarbazol-9-yl(imidazol-1-yl)methanone
SMILESO=C(n1ccnc1)n1c2ccccc2c2ccccc21
InChIInChI=1S/C16H11N3O/c20-16(18-10-9-17-11-18)19-14-7-3-1-5-12(14)13-6-2-4-8-15(13)19/h1-11H
InChIKeyBQWJEYCBTIRBAI-UHFFFAOYSA-N
MW261.28 g/mol
LogP3.51
Rot. Bonds

About carbazol-9-yl(imidazol-1-yl)methanone

carbazol-9-yl(imidazol-1-yl)methanone (PubChem CID 164739630) has the molecular formula C16H11N3O and a molecular weight of 261.28 g/mol. Its IUPAC name is carbazol-9-yl(imidazol-1-yl)methanone.

Molecular Properties

Compound Namecarbazol-9-yl(imidazol-1-yl)methanone
PubChem CID164739630
Molecular FormulaC16H11N3O
Molecular Weight261.28 g/mol
Exact Mass261.09
IUPAC Namecarbazol-9-yl(imidazol-1-yl)methanone
SMILESO=C(n1ccnc1)n1c2ccccc2c2ccccc21
InChIInChI=1S/C16H11N3O/c20-16(18-10-9-17-11-18)19-14-7-3-1-5-12(14)13-6-2-4-8-15(13)19/h1-11H
InChIKeyBQWJEYCBTIRBAI-UHFFFAOYSA-N
XLogP3.51
TPSA39.82 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.28
LogP ≤ 53.51
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

imidazol-1-yl(1H-indazol-3-yl)methanone
CID 10560470
2H-benzotriazol-4-ol;di(imidazol-1-yl)methanone
CID 157286862
hydron;imidazol-1-yl(phenyl)methanone
CID 131844425
1-carbazol-9-ylethanone;ethane
CID 142183368
di(imidazol-1-yl)methanone;pyrrol-1-yl(1,2,4-triazol-4-yl)methanone
CID 160726902
carbazole-9-carbonyl fluoride
CID 45082000
imidazol-1-yl-[2-(trifluoromethyl)phenyl]methanone
CID 110464340
1-imidazol-1-ylethanone;quinoline
CID 161093040
3-(imidazole-1-carbonyl)-4H-pyrazolo[1,5-a]quinazolin-5-one
CID 135925379
di(imidazol-1-yl)methanone;1,2-oxazole
CID 172682616
di(imidazol-1-yl)methanone;[3-hydroxy-4-(2-hydroxy-3-methylnaphthalen-1-yl)naphthalen-2-yl]-imidazol-1-ylmethanone
CID 90784626
3-[2-(imidazole-1-carbonyl)-3,4-dihydro-1H-pyrazino[1,2-a]indol-10-yl]-4-(1-methylindol-3-yl)pyrrole-2,5-dione
CID 19696310

Frequently Asked Questions

What is the IUPAC name of carbazol-9-yl(imidazol-1-yl)methanone?
The IUPAC name of carbazol-9-yl(imidazol-1-yl)methanone (CID 164739630) is carbazol-9-yl(imidazol-1-yl)methanone.
What is the SMILES notation for carbazol-9-yl(imidazol-1-yl)methanone?
The canonical SMILES for carbazol-9-yl(imidazol-1-yl)methanone is O=C(n1ccnc1)n1c2ccccc2c2ccccc21.
What is the InChIKey of carbazol-9-yl(imidazol-1-yl)methanone?
The InChIKey is BQWJEYCBTIRBAI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H11N3O/c20-16(18-10-9-17-11-18)19-14-7-3-1-5-12(14)13-6-2-4-8-15(13)19/h1-11H.
What are the key properties of carbazol-9-yl(imidazol-1-yl)methanone?
carbazol-9-yl(imidazol-1-yl)methanone has a molecular weight of 261.28 g/mol, XLogP of 3.51, 0 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for carbazol-9-yl(imidazol-1-yl)methanone is sourced from PubChem (CID 164739630), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).