7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one

C14H19N3O2 — CID 43449729

IUPAC7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CN(c2cc3c(cc2N)NC(=O)CC3)CCO1
InChIInChI=1S/C14H19N3O2/c1-9-8-17(4-5-19-9)13-6-10-2-3-14(18)16-12(10)7-11(13)15/h6-7,9H,2-5,8,15H2,1H3,(H,16,18)
InChIKeyBKPVCMAEYCSPAR-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.38
Rot. Bonds1

About 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one

7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one (PubChem CID 43449729) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one.

Molecular Properties

Compound Name7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one
PubChem CID43449729
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one
SMILESCC1CN(c2cc3c(cc2N)NC(=O)CC3)CCO1
InChIInChI=1S/C14H19N3O2/c1-9-8-17(4-5-19-9)13-6-10-2-3-14(18)16-12(10)7-11(13)15/h6-7,9H,2-5,8,15H2,1H3,(H,16,18)
InChIKeyBKPVCMAEYCSPAR-UHFFFAOYSA-N
XLogP1.38
TPSA67.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'anil_di_alk_A(478)', 'substructure': 'N/A'}, {'alert_name': 'aniline', 'substructure': 'N/A'}

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Related Compounds

5-amino-6-(2-methylmorpholin-4-yl)-1,3-dihydroindol-2-one
CID 43383153
7-amino-6-(4,4-dimethylpiperidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 62936875
6-amino-7-(3-hydroxy-4-methylpiperidin-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 102955536
6-amino-7-[3-(1-hydroxyethyl)pyrrolidin-1-yl]-3,4-dihydro-1H-quinolin-2-one
CID 115964853
6-amino-7-(azocan-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 43455503
[2-(2-methylmorpholin-4-yl)-2-oxoethyl] 2-oxo-3,4-dihydro-1H-quinoline-6-carboxylate
CID 18130814
5-chloro-2-(2-methylmorpholin-4-yl)aniline
CID 16772686
5-chloro-4-fluoro-2-(2-methylmorpholin-4-yl)aniline
CID 66076593
4-chloro-2-(2-methylmorpholin-4-yl)aniline
CID 115468437
5-amino-2-[(2S)-2-methylmorpholin-4-yl]-1H-pyridin-4-one
CID 178121732
1-(7-amino-2-oxo-3,4-dihydro-1H-quinolin-6-yl)pyrrolidine-2-carboxamide
CID 43449758
7-amino-6-(3,4,5-trimethylpyrazol-1-yl)-3,4-dihydro-1H-quinolin-2-one
CID 61225923

Frequently Asked Questions

What is the IUPAC name of 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one?
The IUPAC name of 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one (CID 43449729) is 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one.
What is the SMILES notation for 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one?
The canonical SMILES for 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one is CC1CN(c2cc3c(cc2N)NC(=O)CC3)CCO1.
What is the InChIKey of 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one?
The InChIKey is BKPVCMAEYCSPAR-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-9-8-17(4-5-19-9)13-6-10-2-3-14(18)16-12(10)7-11(13)15/h6-7,9H,2-5,8,15H2,1H3,(H,16,18).
What are the key properties of 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one?
7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one has a molecular weight of 261.32 g/mol, XLogP of 1.38, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 7-amino-6-(2-methylmorpholin-4-yl)-3,4-dihydro-1H-quinolin-2-one is sourced from PubChem (CID 43449729), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).