1-ethyl-6-propan-2-yl-3H-indol-2-one

C13H17NO — CID 134294019

IUPAC1-ethyl-6-propan-2-yl-3H-indol-2-one
SMILESCCN1C(=O)Cc2ccc(C(C)C)cc21
InChIInChI=1S/C13H17NO/c1-4-14-12-7-10(9(2)3)5-6-11(12)8-13(14)15/h5-7,9H,4,8H2,1-3H3
InChIKeySWOZUENSJFXNTN-UHFFFAOYSA-N
MW203.28 g/mol
LogP2.72
Rot. Bonds2

About 1-ethyl-6-propan-2-yl-3H-indol-2-one

1-ethyl-6-propan-2-yl-3H-indol-2-one (PubChem CID 134294019) has the molecular formula C13H17NO and a molecular weight of 203.28 g/mol. Its IUPAC name is 1-ethyl-6-propan-2-yl-3H-indol-2-one.

Molecular Properties

Compound Name1-ethyl-6-propan-2-yl-3H-indol-2-one
PubChem CID134294019
Molecular FormulaC13H17NO
Molecular Weight203.28 g/mol
Exact Mass203.13
IUPAC Name1-ethyl-6-propan-2-yl-3H-indol-2-one
SMILESCCN1C(=O)Cc2ccc(C(C)C)cc21
InChIInChI=1S/C13H17NO/c1-4-14-12-7-10(9(2)3)5-6-11(12)8-13(14)15/h5-7,9H,4,8H2,1-3H3
InChIKeySWOZUENSJFXNTN-UHFFFAOYSA-N
XLogP2.72
TPSA20.31 Ų
H-Bond Donors
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500203.28
LogP ≤ 52.72
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 101

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Related Compounds

1-ethyl-4-methyl-7-propan-2-yl-3H-quinoxalin-2-one
CID 153308057
1-ethyl-6-(trifluoromethyl)-3H-indol-2-one
CID 117206073
1-ethyl-5-(1-hydroxypropyl)-3H-indol-2-one
CID 82172045
1-ethyl-5-[hydroxy-(4-methylphenyl)methyl]-3H-indol-2-one
CID 82172057
1-[(4-propan-2-ylphenyl)methyl]-3H-indol-2-one
CID 82091764
5-(1-amino-2-phenylethyl)-1-ethyl-3H-indol-2-one
CID 82172041
1-ethyl-5-(methylamino)-3H-indol-2-one
CID 82551072
1,7-di(propan-2-yl)-3,4-dihydroquinolin-2-one;ethane
CID 177158483
5-(1-amino-2-phenoxyethyl)-1-ethyl-3H-indol-2-one
CID 82172043
1-ethyl-7-(1-hydroxyethyl)-4,5-dihydro-3H-1-benzazepin-2-one
CID 82176086
5-(2-aminoethyl)-1-ethyl-3H-indol-2-one
CID 82190443
N-(1-ethyl-2-oxo-3H-indol-5-yl)acetamide
CID 20933157

Frequently Asked Questions

What is the IUPAC name of 1-ethyl-6-propan-2-yl-3H-indol-2-one?
The IUPAC name of 1-ethyl-6-propan-2-yl-3H-indol-2-one (CID 134294019) is 1-ethyl-6-propan-2-yl-3H-indol-2-one.
What is the SMILES notation for 1-ethyl-6-propan-2-yl-3H-indol-2-one?
The canonical SMILES for 1-ethyl-6-propan-2-yl-3H-indol-2-one is CCN1C(=O)Cc2ccc(C(C)C)cc21.
What is the InChIKey of 1-ethyl-6-propan-2-yl-3H-indol-2-one?
The InChIKey is SWOZUENSJFXNTN-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H17NO/c1-4-14-12-7-10(9(2)3)5-6-11(12)8-13(14)15/h5-7,9H,4,8H2,1-3H3.
What are the key properties of 1-ethyl-6-propan-2-yl-3H-indol-2-one?
1-ethyl-6-propan-2-yl-3H-indol-2-one has a molecular weight of 203.28 g/mol, XLogP of 2.72, 2 rotatable bonds, 0 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 1-ethyl-6-propan-2-yl-3H-indol-2-one is sourced from PubChem (CID 134294019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).