11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one

C17H15NO — CID 164675978

IUPAC11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one
SMILESCn1c2c(c3ccc4ccccc4c31)C(=O)CCC2
InChIInChI=1S/C17H15NO/c1-18-14-7-4-8-15(19)16(14)13-10-9-11-5-2-3-6-12(11)17(13)18/h2-3,5-6,9-10H,4,7-8H2,1H3
InChIKeyYKBVWTPZFXDWKI-UHFFFAOYSA-N
MW249.31 g/mol
LogP3.85
Rot. Bonds

About 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one

11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one (PubChem CID 164675978) has the molecular formula C17H15NO and a molecular weight of 249.31 g/mol. Its IUPAC name is 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one.

Molecular Properties

Compound Name11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one
PubChem CID164675978
Molecular FormulaC17H15NO
Molecular Weight249.31 g/mol
Exact Mass249.12
IUPAC Name11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one
SMILESCn1c2c(c3ccc4ccccc4c31)C(=O)CCC2
InChIInChI=1S/C17H15NO/c1-18-14-7-4-8-15(19)16(14)13-10-9-11-5-2-3-6-12(11)17(13)18/h2-3,5-6,9-10H,4,7-8H2,1H3
InChIKeyYKBVWTPZFXDWKI-UHFFFAOYSA-N
XLogP3.85
TPSA22.00 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500249.31
LogP ≤ 53.85
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

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CID 84739991
12,33-dimethyl-12,33-diazanonacyclo[33.7.1.114,22.02,11.05,10.015,20.023,32.026,31.036,41]tetratetraconta-1(42),2(11),3,5,7,9,14(44),15,17,19,21,23(32),24,26,28,30,35(43),36,38,40-icosaene-13,34-dione
CID 58568504
4-oxo-2,3-dihydro-1H-carbazole-9-carboxylic acid
CID 166731468
11-ethyl-7,8,9,10-tetrahydrobenzo[a]carbazole
CID 130355396
9-benzyl-5-oxo-7,8-dihydro-6H-carbazole-1-carboxylic acid
CID 44564826
9-[(4-methoxyphenyl)methyl]-2,3-dihydro-1H-carbazol-4-one
CID 10017977
2-methyl-3-naphthalen-1-yl-6,7-dihydro-5H-1-benzofuran-4-one
CID 102475019
7,8,9,10-tetrahydrobenzo[c]carbazol-11-one
CID 134907120
7-fluoro-6-methyl-2,3,4,5-tetrahydroazepino[4,3-b]indol-1-one
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8,9-dimethoxy-5-methylbenzo[c]phenanthridin-6-one
CID 10245385
(3R)-3-methyl-2,3-dihydrocyclopenta[a]naphthalen-1-one
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CID 14940541

Frequently Asked Questions

What is the IUPAC name of 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one?
The IUPAC name of 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one (CID 164675978) is 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one.
What is the SMILES notation for 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one?
The canonical SMILES for 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one is Cn1c2c(c3ccc4ccccc4c31)C(=O)CCC2.
What is the InChIKey of 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one?
The InChIKey is YKBVWTPZFXDWKI-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H15NO/c1-18-14-7-4-8-15(19)16(14)13-10-9-11-5-2-3-6-12(11)17(13)18/h2-3,5-6,9-10H,4,7-8H2,1H3.
What are the key properties of 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one?
11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one has a molecular weight of 249.31 g/mol, XLogP of 3.85, 0 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for 11-methyl-9,10-dihydro-8H-benzo[a]carbazol-7-one is sourced from PubChem (CID 164675978), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).