6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one

C14H19NO — CID 82113959

IUPAC6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cc(C)c2c(c1)CC(C(C)C)C(=O)N2
InChIInChI=1S/C14H19NO/c1-8(2)12-7-11-6-9(3)5-10(4)13(11)15-14(12)16/h5-6,8,12H,7H2,1-4H3,(H,15,16)
InChIKeyDVEMAXJILTVCOS-UHFFFAOYSA-N
MW217.31 g/mol
LogP3.07
Rot. Bonds1

About 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one

6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one (PubChem CID 82113959) has the molecular formula C14H19NO and a molecular weight of 217.31 g/mol. Its IUPAC name is 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
PubChem CID82113959
Molecular FormulaC14H19NO
Molecular Weight217.31 g/mol
Exact Mass217.15
IUPAC Name6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one
SMILESCc1cc(C)c2c(c1)CC(C(C)C)C(=O)N2
InChIInChI=1S/C14H19NO/c1-8(2)12-7-11-6-9(3)5-10(4)13(11)15-14(12)16/h5-6,8,12H,7H2,1-4H3,(H,15,16)
InChIKeyDVEMAXJILTVCOS-UHFFFAOYSA-N
XLogP3.07
TPSA29.10 Ų
H-Bond Donors1
H-Bond Acceptors1
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500217.31
LogP ≤ 53.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 101

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Related Compounds

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3,6,8-trimethyl-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one
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8-fluoro-6-methyl-2-oxo-3,4-dihydro-1H-quinoline-3-carboxylic acid
CID 114553186
5,7-dimethyl-2-(4-methylphenyl)-2,3-dihydro-1H-indole
CID 4013983
2,4-dimethyl-6a,7,8,9,10,10a-hexahydro-5H-benzo[b][1,4]benzothiazepin-6-one
CID 19002419
5-amino-7,9-dimethyl-1,3,4,5-tetrahydro-1-benzazepin-2-one
CID 82396585
5,7-dimethyl-2-propan-2-yl-3,4-dihydro-2H-1λ6,4-benzothiazine 1,1-dioxide
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(3S)-6,8-dimethyl-3-(oxoboranylmethylideneamino)-1,2,3,5-tetrahydro-1,5-benzodiazepin-4-one
CID 59961018
N-(4-aminocyclohexyl)-5,7-dimethyl-2,3-dihydro-1H-indole-2-carboxamide
CID 146394486
3-(5,7-dimethyl-2,3-dihydro-1H-indol-2-yl)propan-1-amine
CID 83860652
(6aS,8R)-8-(dimethylamino)-2,4-dimethyl-6a,7,8,9-tetrahydro-5H-pyrrolo[2,1-c][1,4]benzodiazepine-6,11-dione
CID 122556871

Frequently Asked Questions

What is the IUPAC name of 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one (CID 82113959) is 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one is Cc1cc(C)c2c(c1)CC(C(C)C)C(=O)N2.
What is the InChIKey of 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is DVEMAXJILTVCOS-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19NO/c1-8(2)12-7-11-6-9(3)5-10(4)13(11)15-14(12)16/h5-6,8,12H,7H2,1-4H3,(H,15,16).
What are the key properties of 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one?
6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 217.31 g/mol, XLogP of 3.07, 1 rotatable bonds, 1 hydrogen bond donors, and 1 hydrogen bond acceptors.
Where does this data come from?
All data for 6,8-dimethyl-3-propan-2-yl-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 82113959), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).