(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone

C15H17N3O2 — CID 106774608

IUPAC(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
SMILESC[C@@H]1COCCN1C(=O)c1cc(N)c2ccccc2n1
InChIInChI=1S/C15H17N3O2/c1-10-9-20-7-6-18(10)15(19)14-8-12(16)11-4-2-3-5-13(11)17-14/h2-5,8,10H,6-7,9H2,1H3,(H2,16,17)/t10-/m1/s1
InChIKeySOEMFWGEQAIASR-SNVBAGLBSA-N
MW271.32 g/mol
LogP1.68
Rot. Bonds1

About (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone

(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone (PubChem CID 106774608) has the molecular formula C15H17N3O2 and a molecular weight of 271.32 g/mol. Its IUPAC name is (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone.

Molecular Properties

Compound Name(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
PubChem CID106774608
Molecular FormulaC15H17N3O2
Molecular Weight271.32 g/mol
Exact Mass271.13
IUPAC Name(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
SMILESC[C@@H]1COCCN1C(=O)c1cc(N)c2ccccc2n1
InChIInChI=1S/C15H17N3O2/c1-10-9-20-7-6-18(10)15(19)14-8-12(16)11-4-2-3-5-13(11)17-14/h2-5,8,10H,6-7,9H2,1H3,(H2,16,17)/t10-/m1/s1
InChIKeySOEMFWGEQAIASR-SNVBAGLBSA-N
XLogP1.68
TPSA68.45 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500271.32
LogP ≤ 51.68
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

[1-(2-aminophenyl)pyrazol-3-yl]-(3-methylmorpholin-4-yl)methanone
CID 43541582
4-aminoquinoline-2-carboxylic acid;hydrochloride
CID 171379335
(3-methylmorpholin-4-yl)-(6-propan-2-yl-2-pyridinyl)methanone
CID 177347142
6-[(3S)-3-methylmorpholine-4-carbonyl]-2-phenylpyridazin-3-one
CID 94095562
(3-methylmorpholin-4-yl)-(3-phenylphenyl)methanone
CID 110292242
(3-methylmorpholin-4-yl)-(4-methyl-2-phenyl-1,3-thiazol-5-yl)methanone
CID 110309752
(5-amino-7-methoxyimidazo[1,2-c]quinazolin-2-yl)-[(3S)-3-methylmorpholin-4-yl]methanone
CID 138689546
(4-amino-1-methylpyrazol-5-yl)-[(3R)-3-methylmorpholin-4-yl]methanone
CID 106773672
2-[(3S)-3-methylmorpholine-4-carbonyl]benzonitrile
CID 130179782
[2-(2,3-dimethoxyphenyl)-1,3-thiazol-4-yl]-(3-methylmorpholin-4-yl)methanone
CID 51078085
2-amino-3-(1H-indol-3-yl)-1-[(3R)-3-methylmorpholin-4-yl]propan-1-one
CID 106774384
(5-amino-2-methylphenyl)-(3-methylmorpholin-4-yl)methanone;hydrochloride
CID 120623273

Frequently Asked Questions

What is the IUPAC name of (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The IUPAC name of (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone (CID 106774608) is (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone.
What is the SMILES notation for (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The canonical SMILES for (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone is C[C@@H]1COCCN1C(=O)c1cc(N)c2ccccc2n1.
What is the InChIKey of (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
The InChIKey is SOEMFWGEQAIASR-SNVBAGLBSA-N. The full InChI is InChI=1S/C15H17N3O2/c1-10-9-20-7-6-18(10)15(19)14-8-12(16)11-4-2-3-5-13(11)17-14/h2-5,8,10H,6-7,9H2,1H3,(H2,16,17)/t10-/m1/s1.
What are the key properties of (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone?
(4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone has a molecular weight of 271.32 g/mol, XLogP of 1.68, 1 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (4-aminoquinolin-2-yl)-[(3R)-3-methylmorpholin-4-yl]methanone is sourced from PubChem (CID 106774608), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).