8-ethyl-2-propan-2-yl-1H-quinolin-4-one

C14H17NO — CID 43668106

IUPAC8-ethyl-2-propan-2-yl-1H-quinolin-4-one
SMILESCCc1cccc2c(=O)cc(C(C)C)[nH]c12
InChIInChI=1S/C14H17NO/c1-4-10-6-5-7-11-13(16)8-12(9(2)3)15-14(10)11/h5-9H,4H2,1-3H3,(H,15,16)
InChIKeyULVLYUARSSIFRN-UHFFFAOYSA-N
MW215.30 g/mol
LogP3.21
Rot. Bonds2

About 8-ethyl-2-propan-2-yl-1H-quinolin-4-one

8-ethyl-2-propan-2-yl-1H-quinolin-4-one (PubChem CID 43668106) has the molecular formula C14H17NO and a molecular weight of 215.30 g/mol. Its IUPAC name is 8-ethyl-2-propan-2-yl-1H-quinolin-4-one.

Molecular Properties

Compound Name8-ethyl-2-propan-2-yl-1H-quinolin-4-one
PubChem CID43668106
Molecular FormulaC14H17NO
Molecular Weight215.30 g/mol
Exact Mass215.13
IUPAC Name8-ethyl-2-propan-2-yl-1H-quinolin-4-one
SMILESCCc1cccc2c(=O)cc(C(C)C)[nH]c12
InChIInChI=1S/C14H17NO/c1-4-10-6-5-7-11-13(16)8-12(9(2)3)15-14(10)11/h5-9H,4H2,1-3H3,(H,15,16)
InChIKeyULVLYUARSSIFRN-UHFFFAOYSA-N
XLogP3.21
TPSA32.86 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds2
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.30
LogP ≤ 53.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Frequently Asked Questions

What is the IUPAC name of 8-ethyl-2-propan-2-yl-1H-quinolin-4-one?
The IUPAC name of 8-ethyl-2-propan-2-yl-1H-quinolin-4-one (CID 43668106) is 8-ethyl-2-propan-2-yl-1H-quinolin-4-one.
What is the SMILES notation for 8-ethyl-2-propan-2-yl-1H-quinolin-4-one?
The canonical SMILES for 8-ethyl-2-propan-2-yl-1H-quinolin-4-one is CCc1cccc2c(=O)cc(C(C)C)[nH]c12.
What is the InChIKey of 8-ethyl-2-propan-2-yl-1H-quinolin-4-one?
The InChIKey is ULVLYUARSSIFRN-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H17NO/c1-4-10-6-5-7-11-13(16)8-12(9(2)3)15-14(10)11/h5-9H,4H2,1-3H3,(H,15,16).
What are the key properties of 8-ethyl-2-propan-2-yl-1H-quinolin-4-one?
8-ethyl-2-propan-2-yl-1H-quinolin-4-one has a molecular weight of 215.30 g/mol, XLogP of 3.21, 2 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 8-ethyl-2-propan-2-yl-1H-quinolin-4-one is sourced from PubChem (CID 43668106), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).