2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one

C16H19NO — CID 63351442

IUPAC2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one
SMILESCCc1ccc2[nH]c3c(c(=O)c2c1)CCCCC3
InChIInChI=1S/C16H19NO/c1-2-11-8-9-15-13(10-11)16(18)12-6-4-3-5-7-14(12)17-15/h8-10H,2-7H2,1H3,(H,17,18)
InChIKeyFVPWQDFYMBYSSQ-UHFFFAOYSA-N
MW241.33 g/mol
LogP3.36
Rot. Bonds1

About 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one

2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one (PubChem CID 63351442) has the molecular formula C16H19NO and a molecular weight of 241.33 g/mol. Its IUPAC name is 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one.

Molecular Properties

Compound Name2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one
PubChem CID63351442
Molecular FormulaC16H19NO
Molecular Weight241.33 g/mol
Exact Mass241.15
IUPAC Name2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one
SMILESCCc1ccc2[nH]c3c(c(=O)c2c1)CCCCC3
InChIInChI=1S/C16H19NO/c1-2-11-8-9-15-13(10-11)16(18)12-6-4-3-5-7-14(12)17-15/h8-10H,2-7H2,1H3,(H,17,18)
InChIKeyFVPWQDFYMBYSSQ-UHFFFAOYSA-N
XLogP3.36
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500241.33
LogP ≤ 53.36
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

7-tert-butyl-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
CID 58759349
7-nitro-2,3,4,10-tetrahydro-1H-acridin-9-one
CID 6324703
N-cyclohexyl-2-(8-ethyl-10-oxo-1,3,4,5-tetrahydrobenzo[b][1,6]naphthyridin-2-yl)acetamide
CID 53114184
7-[4-(trifluoromethyl)phenyl]-2,3,4,10-tetrahydro-1H-acridin-9-one
CID 53362611
6,7,8,9-tetrahydro-5H-carbazol-3-ylmethanamine
CID 3156790
N-(3-ethylphenyl)-5,6,7,8,9,10-hexahydrocyclohepta[b]indole-2-sulfonamide
CID 20970048
3-methoxy-6,7,8,9,10,11-hexahydro-5H-cycloocta[b]quinolin-12-one
CID 53362916
6-ethyl-2,3,4,9-tetrahydro-1H-carbazole-4-carboxylic acid
CID 84630858
6-ethyl-2,3,4,9-tetrahydro-1H-carbazol-3-amine
CID 82275010
6-ethyl-2-methyl-3-(piperidin-1-ylmethyl)-1H-quinolin-4-one
CID 702770
2-ethoxy-5,6,7,8,9,10-hexahydrocyclohepta[b]indole
CID 107958588
7-(4-chlorophenoxy)-1,2,3,4-tetrahydrocyclopenta[b]quinolin-9-one
CID 172712083

Frequently Asked Questions

What is the IUPAC name of 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one?
The IUPAC name of 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one (CID 63351442) is 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one.
What is the SMILES notation for 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one?
The canonical SMILES for 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one is CCc1ccc2[nH]c3c(c(=O)c2c1)CCCCC3.
What is the InChIKey of 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one?
The InChIKey is FVPWQDFYMBYSSQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H19NO/c1-2-11-8-9-15-13(10-11)16(18)12-6-4-3-5-7-14(12)17-15/h8-10H,2-7H2,1H3,(H,17,18).
What are the key properties of 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one?
2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one has a molecular weight of 241.33 g/mol, XLogP of 3.36, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 2-ethyl-5,6,7,8,9,10-hexahydrocyclohepta[b]quinolin-11-one is sourced from PubChem (CID 63351442), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).