2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one

C15H19NO2 — CID 176548680

IUPAC2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one
SMILESCC(C)n1c(C(C)(C)O)cc(=O)c2ccccc21
InChIInChI=1S/C15H19NO2/c1-10(2)16-12-8-6-5-7-11(12)13(17)9-14(16)15(3,4)18/h5-10,18H,1-4H3
InChIKeyQOGTVUIESOFHNM-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.81
Rot. Bonds2

About 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one

2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one (PubChem CID 176548680) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one.

Molecular Properties

Compound Name2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one
PubChem CID176548680
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one
SMILESCC(C)n1c(C(C)(C)O)cc(=O)c2ccccc21
InChIInChI=1S/C15H19NO2/c1-10(2)16-12-8-6-5-7-11(12)13(17)9-14(16)15(3,4)18/h5-10,18H,1-4H3
InChIKeyQOGTVUIESOFHNM-UHFFFAOYSA-N
XLogP2.81
TPSA42.23 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.81
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

1-butan-2-yl-4-oxoquinoline-2-carboxylic acid
CID 82244126
2-(2-aminopropan-2-yl)-1-propan-2-ylindol-4-ol
CID 117120582
3-iodo-2-methyl-1-propan-2-ylquinolin-4-one
CID 176548683
3-methyl-3-(9-propan-2-ylcarbazol-3-yl)butanoic acid
CID 117494202
9-propan-2-yl-2-(9-propan-2-ylcarbazol-2-yl)carbazole
CID 170205010
9-methoxy-5-propan-2-ylcyclohepta[b]indol-6-one
CID 139810032
2-(4-chloro-1-propan-2-ylindol-2-yl)propan-2-amine
CID 117120452
2-(7-chloro-1-propan-2-ylindol-2-yl)propan-2-ol
CID 117196918
9-propan-2-ylcarbazole-3-carbaldehyde
CID 16762077
4-amino-1-propan-2-ylquinazolin-2-one
CID 156889369
1-tert-butyl-2-phenylquinolin-4-one
CID 166440287
3,5-dinitrobenzoic acid;9-propan-2-ylcarbazole
CID 139057652

Frequently Asked Questions

What is the IUPAC name of 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one?
The IUPAC name of 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one (CID 176548680) is 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one.
What is the SMILES notation for 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one?
The canonical SMILES for 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one is CC(C)n1c(C(C)(C)O)cc(=O)c2ccccc21.
What is the InChIKey of 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one?
The InChIKey is QOGTVUIESOFHNM-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-10(2)16-12-8-6-5-7-11(12)13(17)9-14(16)15(3,4)18/h5-10,18H,1-4H3.
What are the key properties of 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one?
2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one has a molecular weight of 245.32 g/mol, XLogP of 2.81, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 2-(2-hydroxypropan-2-yl)-1-propan-2-ylquinolin-4-one is sourced from PubChem (CID 176548680), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).