9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one

C14H15NO2 — CID 71469389

IUPAC9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one
SMILESCCC1(O)CCC(=O)n2c1cc1ccccc12
InChIInChI=1S/C14H15NO2/c1-2-14(17)8-7-13(16)15-11-6-4-3-5-10(11)9-12(14)15/h3-6,9,17H,2,7-8H2,1H3
InChIKeyUFSJFWIBEUGHKM-UHFFFAOYSA-N
MW229.28 g/mol
LogP2.67
Rot. Bonds1

About 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one

9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one (PubChem CID 71469389) has the molecular formula C14H15NO2 and a molecular weight of 229.28 g/mol. Its IUPAC name is 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one.

Molecular Properties

Compound Name9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one
PubChem CID71469389
Molecular FormulaC14H15NO2
Molecular Weight229.28 g/mol
Exact Mass229.11
IUPAC Name9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one
SMILESCCC1(O)CCC(=O)n2c1cc1ccccc12
InChIInChI=1S/C14H15NO2/c1-2-14(17)8-7-13(16)15-11-6-4-3-5-10(11)9-12(14)15/h3-6,9,17H,2,7-8H2,1H3
InChIKeyUFSJFWIBEUGHKM-UHFFFAOYSA-N
XLogP2.67
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds1
Heavy Atoms17
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500229.28
LogP ≤ 52.67
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

methyl (2Z)-4-[(9R)-9-ethyl-6-oxo-7,8-dihydropyrido[1,2-a]indol-9-yl]-2-methoxyimino-3-oxobutanoate
CID 139185433
10-fluoro-2-methyl-6,14-diazapentacyclo[12.7.0.02,6.07,12.015,20]henicosa-1(21),7(12),8,10,15,17,19-heptaene-5,13-dione
CID 51355763
1-(1-methylindol-2-yl)cyclobutan-1-ol
CID 102201161
9-amino-8,9-dihydro-7H-pyrido[1,2-a]indol-6-one
CID 10821901
ethane;1-ethyl-2,3-dihydroinden-1-ol
CID 90872603
3H-pyrazino[1,2-a]indol-4-one
CID 141364552
3,3-dimethyl-1,2-dihydropyrrolo[1,2-a]indole
CID 15287249
3-[1-(hydroxymethyl)cyclopropyl]-1-methylquinolin-2-one
CID 116985117
3,4-diethyl-4-hydroxycyclohex-2-en-1-one
CID 134895720
methyl (5R,8S)-5-ethyl-8-(methoxyamino)-2,7-dioxo-1-azatetracyclo[7.6.1.05,16.010,15]hexadeca-9(16),10,12,14-tetraene-8-carboxylate
CID 122368129
ethyl 1-oxo-2,3-dihydropyrrolo[1,2-a]indole-2-carboxylate
CID 67807991
1-ethyl-3-(4-oxocyclohexyl)quinolin-2-one
CID 116985579

Frequently Asked Questions

What is the IUPAC name of 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one?
The IUPAC name of 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one (CID 71469389) is 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one.
What is the SMILES notation for 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one?
The canonical SMILES for 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one is CCC1(O)CCC(=O)n2c1cc1ccccc12.
What is the InChIKey of 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one?
The InChIKey is UFSJFWIBEUGHKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H15NO2/c1-2-14(17)8-7-13(16)15-11-6-4-3-5-10(11)9-12(14)15/h3-6,9,17H,2,7-8H2,1H3.
What are the key properties of 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one?
9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one has a molecular weight of 229.28 g/mol, XLogP of 2.67, 1 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 9-ethyl-9-hydroxy-7,8-dihydropyrido[1,2-a]indol-6-one is sourced from PubChem (CID 71469389), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).