(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone

C15H19NO2 — CID 75921285

IUPAC(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
SMILESCC1CCN(C(=O)C2CCOC2)c2ccccc21
InChIInChI=1S/C15H19NO2/c1-11-6-8-16(14-5-3-2-4-13(11)14)15(17)12-7-9-18-10-12/h2-5,11-12H,6-10H2,1H3
InChIKeyZOPCYLCYHHKBIV-UHFFFAOYSA-N
MW245.32 g/mol
LogP2.56
Rot. Bonds1

About (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone

(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone (PubChem CID 75921285) has the molecular formula C15H19NO2 and a molecular weight of 245.32 g/mol. Its IUPAC name is (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone.

Molecular Properties

Compound Name(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
PubChem CID75921285
Molecular FormulaC15H19NO2
Molecular Weight245.32 g/mol
Exact Mass245.14
IUPAC Name(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone
SMILESCC1CCN(C(=O)C2CCOC2)c2ccccc21
InChIInChI=1S/C15H19NO2/c1-11-6-8-16(14-5-3-2-4-13(11)14)15(17)12-7-9-18-10-12/h2-5,11-12H,6-10H2,1H3
InChIKeyZOPCYLCYHHKBIV-UHFFFAOYSA-N
XLogP2.56
TPSA29.54 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500245.32
LogP ≤ 52.56
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

2-[1-(oxolane-3-carbonyl)-2,3-dihydroindol-3-yl]acetic acid
CID 80573868
oxolan-3-yl(1,2,3,4-tetrahydro-1,5-benzodiazepin-5-yl)methanone
CID 64851976
(4-hydroxyimino-2,3-dihydroquinolin-1-yl)-(oxolan-3-yl)methanone
CID 77033492
1-(4-methyl-3,4-dihydro-2H-quinolin-1-yl)butan-1-one
CID 71106683
(3-methyl-2,3-dihydro-1,4-benzoxazin-4-yl)-(oxolan-3-yl)methanone
CID 71987117
cyclopentyl-(3-methyl-2,3-dihydroindol-1-yl)methanone
CID 110751863
3,4-dihydro-2H-quinolin-1-yl(oxan-3-yl)methanone
CID 71879683
(4-aminophenyl)-(4-methyl-3,4-dihydro-2H-quinolin-1-yl)methanone
CID 19607756
2-(ethylamino)-1-(4-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 113266315
2-anilino-1-(4-methyl-3,4-dihydro-2H-quinolin-1-yl)ethanone
CID 119733412
[(2R)-4-(2-fluorophenyl)-2-methylpiperazin-1-yl]-[(3R)-oxolan-3-yl]methanone
CID 99830247
[(2R)-6-bromo-2-methyl-2,3-dihydro-1,4-benzoxazin-4-yl]-[(3R)-oxolan-3-yl]methanone
CID 99843595

Frequently Asked Questions

What is the IUPAC name of (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The IUPAC name of (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone (CID 75921285) is (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone.
What is the SMILES notation for (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The canonical SMILES for (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone is CC1CCN(C(=O)C2CCOC2)c2ccccc21.
What is the InChIKey of (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
The InChIKey is ZOPCYLCYHHKBIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H19NO2/c1-11-6-8-16(14-5-3-2-4-13(11)14)15(17)12-7-9-18-10-12/h2-5,11-12H,6-10H2,1H3.
What are the key properties of (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone?
(4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone has a molecular weight of 245.32 g/mol, XLogP of 2.56, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-3,4-dihydro-2H-quinolin-1-yl)-(oxolan-3-yl)methanone is sourced from PubChem (CID 75921285), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).