(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide

C20H29N3O3 — CID 95352082

IUPAC(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide
SMILESC[C@@H]1CN(C(=O)NCCC(=O)N2CCCc3ccccc32)CC(C)(C)O1
InChIInChI=1S/C20H29N3O3/c1-15-13-22(14-20(2,3)26-15)19(25)21-11-10-18(24)23-12-6-8-16-7-4-5-9-17(16)23/h4-5,7,9,15H,6,8,10-14H2,1-3H3,(H,21,25)/t15-/m1/s1
InChIKeyZFSCXBYHMBZBRW-OAHLLOKOSA-N
MW359.47 g/mol
LogP2.56
Rot. Bonds3

About (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide

(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide (PubChem CID 95352082) has the molecular formula C20H29N3O3 and a molecular weight of 359.47 g/mol. Its IUPAC name is (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide.

Molecular Properties

Compound Name(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide
PubChem CID95352082
Molecular FormulaC20H29N3O3
Molecular Weight359.47 g/mol
Exact Mass359.22
IUPAC Name(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide
SMILESC[C@@H]1CN(C(=O)NCCC(=O)N2CCCc3ccccc32)CC(C)(C)O1
InChIInChI=1S/C20H29N3O3/c1-15-13-22(14-20(2,3)26-15)19(25)21-11-10-18(24)23-12-6-8-16-7-4-5-9-17(16)23/h4-5,7,9,15H,6,8,10-14H2,1-3H3,(H,21,25)/t15-/m1/s1
InChIKeyZFSCXBYHMBZBRW-OAHLLOKOSA-N
XLogP2.56
TPSA61.88 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500359.47
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Analyze (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide with MolForge

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Related Compounds

1-(2,3-dihydroindol-1-yl)-3-(2,2,6-trimethylmorpholin-4-yl)propan-1-one
CID 48633177
3-(carbamoylamino)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]propanamide
CID 154773989
1-(3,4-dihydro-2H-quinolin-1-yl)-3-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]sulfanylpropan-1-one
CID 3609864
1,9-bis(3,4-dihydro-2H-quinolin-1-yl)nonane-1,9-dione
CID 5158868
N-(1-acetyl-2,3-dihydroindol-5-yl)-2,2,6-trimethylmorpholine-4-carboxamide
CID 48639256
1-(3,4-dihydro-2H-quinolin-1-yl)-3-(2-phenylethylamino)propan-1-one
CID 109024285
(6S)-N-[2-(4-chlorophenyl)sulfonylethyl]-2,2,6-trimethylmorpholine-4-carboxamide
CID 95137726
4-(3,4-dihydro-2H-quinolin-1-yl)-4-oxobutanoate
CID 3663082
3-cyclohexyl-1-(3,4-dihydro-2H-quinolin-1-yl)propan-1-one
CID 2300886
4-acetyl-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-3,5-dimethyl-1H-pyrrole-2-carboxamide
CID 71891299
N'-[2-(3,4-dihydro-2H-quinolin-1-yl)-2-oxoethyl]-2-methylmorpholine-4-carboximidamide
CID 120661382
5-amino-1-(3,4-dihydro-2H-quinolin-1-yl)-4-methylpentan-1-one
CID 82683241

Frequently Asked Questions

What is the IUPAC name of (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide?
The IUPAC name of (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide (CID 95352082) is (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide.
What is the SMILES notation for (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide?
The canonical SMILES for (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide is C[C@@H]1CN(C(=O)NCCC(=O)N2CCCc3ccccc32)CC(C)(C)O1.
What is the InChIKey of (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide?
The InChIKey is ZFSCXBYHMBZBRW-OAHLLOKOSA-N. The full InChI is InChI=1S/C20H29N3O3/c1-15-13-22(14-20(2,3)26-15)19(25)21-11-10-18(24)23-12-6-8-16-7-4-5-9-17(16)23/h4-5,7,9,15H,6,8,10-14H2,1-3H3,(H,21,25)/t15-/m1/s1.
What are the key properties of (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide?
(6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide has a molecular weight of 359.47 g/mol, XLogP of 2.56, 3 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for (6R)-N-[3-(3,4-dihydro-2H-quinolin-1-yl)-3-oxopropyl]-2,2,6-trimethylmorpholine-4-carboxamide is sourced from PubChem (CID 95352082), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).