N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide

C16H18ClN3O3 — CID 163212668

IUPACN-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide
SMILESCOc1cc2nccc(Cl)c2cc1NC(=O)CC1CNCCO1
InChIInChI=1S/C16H18ClN3O3/c1-22-15-8-13-11(12(17)2-3-19-13)7-14(15)20-16(21)6-10-9-18-4-5-23-10/h2-3,7-8,10,18H,4-6,9H2,1H3,(H,20,21)
InChIKeyJNXFUPUKARYGBC-UHFFFAOYSA-N
MW335.79 g/mol
LogP2.21
Rot. Bonds4

About N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide

N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide (PubChem CID 163212668) has the molecular formula C16H18ClN3O3 and a molecular weight of 335.79 g/mol. Its IUPAC name is N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide.

Molecular Properties

Compound NameN-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide
PubChem CID163212668
Molecular FormulaC16H18ClN3O3
Molecular Weight335.79 g/mol
Exact Mass335.10
IUPAC NameN-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide
SMILESCOc1cc2nccc(Cl)c2cc1NC(=O)CC1CNCCO1
InChIInChI=1S/C16H18ClN3O3/c1-22-15-8-13-11(12(17)2-3-19-13)7-14(15)20-16(21)6-10-9-18-4-5-23-10/h2-3,7-8,10,18H,4-6,9H2,1H3,(H,20,21)
InChIKeyJNXFUPUKARYGBC-UHFFFAOYSA-N
XLogP2.21
TPSA72.48 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.79
LogP ≤ 52.21
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

4-methoxy-3-[(2-morpholin-2-ylacetyl)amino]benzoic acid
CID 66429390
N-(4,5-dimethoxy-2-methylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119679107
(4-chloro-7-methoxyquinolin-6-yl)carbamic acid
CID 22936428
N-(2,5-diethoxyphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119686964
N-(4-methyl-2-pyridinyl)-2-morpholin-2-ylacetamide
CID 66434156
N-(3,4-dichlorophenyl)-2-morpholin-2-ylacetamide
CID 66435697
N-(2-methyl-4-pyridinyl)-2-morpholin-2-ylacetamide
CID 79241107
N-(2-chloro-5-fluorophenyl)-2-morpholin-2-ylacetamide
CID 113266175
methyl 4-fluoro-2-[(2-morpholin-2-ylacetyl)amino]benzoate
CID 66428476
N-(3-chloro-2-methylphenyl)-2-morpholin-2-ylacetamide;hydrochloride
CID 119671783
2-morpholin-2-yl-N-pyrimidin-2-ylacetamide
CID 66435900
N-[2-(3,4-dimethoxyphenyl)ethyl]-2-morpholin-2-ylacetamide
CID 119675375

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide?
The IUPAC name of N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide (CID 163212668) is N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide.
What is the SMILES notation for N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide?
The canonical SMILES for N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide is COc1cc2nccc(Cl)c2cc1NC(=O)CC1CNCCO1.
What is the InChIKey of N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide?
The InChIKey is JNXFUPUKARYGBC-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H18ClN3O3/c1-22-15-8-13-11(12(17)2-3-19-13)7-14(15)20-16(21)6-10-9-18-4-5-23-10/h2-3,7-8,10,18H,4-6,9H2,1H3,(H,20,21).
What are the key properties of N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide?
N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide has a molecular weight of 335.79 g/mol, XLogP of 2.21, 4 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-7-methoxyquinolin-6-yl)-2-morpholin-2-ylacetamide is sourced from PubChem (CID 163212668), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).