[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone

C17H24N2O2 — CID 81316493

IUPAC[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone
SMILESCCNC1CCN(C(=O)C2CCC(C)O2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-3-18-14-10-11-19(15-7-5-4-6-13(14)15)17(20)16-9-8-12(2)21-16/h4-7,12,14,16,18H,3,8-11H2,1-2H3
InChIKeyDTGBVFHPZYBXIV-UHFFFAOYSA-N
MW288.39 g/mol
LogP2.64
Rot. Bonds3

About [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone

[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone (PubChem CID 81316493) has the molecular formula C17H24N2O2 and a molecular weight of 288.39 g/mol. Its IUPAC name is [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone.

Molecular Properties

Compound Name[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone
PubChem CID81316493
Molecular FormulaC17H24N2O2
Molecular Weight288.39 g/mol
Exact Mass288.18
IUPAC Name[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone
SMILESCCNC1CCN(C(=O)C2CCC(C)O2)c2ccccc21
InChIInChI=1S/C17H24N2O2/c1-3-18-14-10-11-19(15-7-5-4-6-13(14)15)17(20)16-9-8-12(2)21-16/h4-7,12,14,16,18H,3,8-11H2,1-2H3
InChIKeyDTGBVFHPZYBXIV-UHFFFAOYSA-N
XLogP2.64
TPSA41.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone?
The IUPAC name of [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone (CID 81316493) is [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone.
What is the SMILES notation for [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone?
The canonical SMILES for [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone is CCNC1CCN(C(=O)C2CCC(C)O2)c2ccccc21.
What is the InChIKey of [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone?
The InChIKey is DTGBVFHPZYBXIV-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H24N2O2/c1-3-18-14-10-11-19(15-7-5-4-6-13(14)15)17(20)16-9-8-12(2)21-16/h4-7,12,14,16,18H,3,8-11H2,1-2H3.
What are the key properties of [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone?
[4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone has a molecular weight of 288.39 g/mol, XLogP of 2.64, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [4-(ethylamino)-3,4-dihydro-2H-quinolin-1-yl]-(5-methyloxolan-2-yl)methanone is sourced from PubChem (CID 81316493), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).