7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one

C16H24N2O2 — CID 103075234

IUPAC7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESCC(CNC(C)C)COc1ccc2c(c1)NC(=O)CC2
InChIInChI=1S/C16H24N2O2/c1-11(2)17-9-12(3)10-20-14-6-4-13-5-7-16(19)18-15(13)8-14/h4,6,8,11-12,17H,5,7,9-10H2,1-3H3,(H,18,19)
InChIKeyIINWKSNDILGJMR-UHFFFAOYSA-N
MW276.38 g/mol
LogP2.58
Rot. Bonds6

About 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one

7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one (PubChem CID 103075234) has the molecular formula C16H24N2O2 and a molecular weight of 276.38 g/mol. Its IUPAC name is 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one
PubChem CID103075234
Molecular FormulaC16H24N2O2
Molecular Weight276.38 g/mol
Exact Mass276.18
IUPAC Name7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one
SMILESCC(CNC(C)C)COc1ccc2c(c1)NC(=O)CC2
InChIInChI=1S/C16H24N2O2/c1-11(2)17-9-12(3)10-20-14-6-4-13-5-7-16(19)18-15(13)8-14/h4,6,8,11-12,17H,5,7,9-10H2,1-3H3,(H,18,19)
InChIKeyIINWKSNDILGJMR-UHFFFAOYSA-N
XLogP2.58
TPSA50.36 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500276.38
LogP ≤ 52.58
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

7-[3-(cyclopropylamino)-2-methylpropoxy]-3,4-dihydro-1H-quinolin-2-one
CID 103075237
6-[3-(tert-butylamino)-2-methylpropoxy]-3,4-dihydro-1H-quinolin-2-one
CID 103074282
3-(2,3-dihydro-1H-inden-5-yloxy)-2-methyl-N-propan-2-ylpropan-1-amine
CID 62459279
7-(2,2-diethoxyethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114939923
7-(2-oxopropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 112704281
N-(3-methylbutan-2-yl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]acetamide
CID 114940002
7-(3-bromo-2-hydroxypropoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114939907
7-(4-methoxybutoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940015
4-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]butanal
CID 56851120
N-(2-methylpropyl)-2-[(2-oxo-3,4-dihydro-1H-quinolin-7-yl)oxy]propanamide
CID 114939986
7-(2-ethylsulfonylethoxy)-3,4-dihydro-1H-quinolin-2-one
CID 114940190
7-[(4-ethylphenyl)methoxy]-3,4-dihydro-1H-quinolin-2-one
CID 114940161

Frequently Asked Questions

What is the IUPAC name of 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one (CID 103075234) is 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one is CC(CNC(C)C)COc1ccc2c(c1)NC(=O)CC2.
What is the InChIKey of 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is IINWKSNDILGJMR-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N2O2/c1-11(2)17-9-12(3)10-20-14-6-4-13-5-7-16(19)18-15(13)8-14/h4,6,8,11-12,17H,5,7,9-10H2,1-3H3,(H,18,19).
What are the key properties of 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one?
7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 276.38 g/mol, XLogP of 2.58, 6 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 7-[2-methyl-3-(propan-2-ylamino)propoxy]-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 103075234), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).