N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide

C17H20ClN3O3 — CID 155168942

IUPACN-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide
SMILESCOc1c(NC(=O)CCN2CCOCC2)ccc2c(Cl)ccnc12
InChIInChI=1S/C17H20ClN3O3/c1-23-17-14(3-2-12-13(18)4-6-19-16(12)17)20-15(22)5-7-21-8-10-24-11-9-21/h2-4,6H,5,7-11H2,1H3,(H,20,22)
InChIKeyKMQQKSLKJVUEDS-UHFFFAOYSA-N
MW349.82 g/mol
LogP2.56
Rot. Bonds5

About N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide

N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide (PubChem CID 155168942) has the molecular formula C17H20ClN3O3 and a molecular weight of 349.82 g/mol. Its IUPAC name is N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide.

Molecular Properties

Compound NameN-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide
PubChem CID155168942
Molecular FormulaC17H20ClN3O3
Molecular Weight349.82 g/mol
Exact Mass349.12
IUPAC NameN-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide
SMILESCOc1c(NC(=O)CCN2CCOCC2)ccc2c(Cl)ccnc12
InChIInChI=1S/C17H20ClN3O3/c1-23-17-14(3-2-12-13(18)4-6-19-16(12)17)20-15(22)5-7-21-8-10-24-11-9-21/h2-4,6H,5,7-11H2,1H3,(H,20,22)
InChIKeyKMQQKSLKJVUEDS-UHFFFAOYSA-N
XLogP2.56
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500349.82
LogP ≤ 52.56
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

N-[3-[[(4-chloro-8-fluoroquinolin-7-yl)amino]methyl]phenyl]-3-morpholin-4-ylpropanamide
CID 133297848
N-(2,4-dimethoxyphenyl)-3-morpholin-4-ylpropanamide
CID 772656
N-(4-amino-2-chlorophenyl)-3-(1,4-oxazepan-4-yl)propanamide
CID 62986506
N-(2-amino-4-methoxyphenyl)-3-(1,4-oxazepan-4-yl)propanamide
CID 62988964
N-(2-fluorophenyl)-3-morpholin-4-ylpropanamide
CID 575001
3-morpholin-4-yl-N-[5-(3-morpholin-4-ylpropanoylamino)-9,10-dioxoanthracen-1-yl]propanamide
CID 10815829
N-(2-chloro-4,6-dimethylphenyl)-3-morpholin-4-ylpropanamide
CID 110688490
4-chloro-7-methoxy-N-(3-morpholin-4-ylpropyl)quinoline-6-carboxamide
CID 22988091
N-(2-methyl-1H-indol-4-yl)-3-morpholin-4-ylpropanamide
CID 138457611
N-(2,6-dichlorophenyl)-3-[4-(2-morpholin-4-ylethyl)piperidin-1-yl]propanamide
CID 56526318
N-(2-chlorophenyl)-3-(4-pyrimidin-2-ylpiperazin-1-yl)propanamide
CID 24587396
N-(2-aminophenyl)-3-(1,4-oxazepan-4-yl)propanamide
CID 55151809

Frequently Asked Questions

What is the IUPAC name of N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide?
The IUPAC name of N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide (CID 155168942) is N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide.
What is the SMILES notation for N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide?
The canonical SMILES for N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide is COc1c(NC(=O)CCN2CCOCC2)ccc2c(Cl)ccnc12.
What is the InChIKey of N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide?
The InChIKey is KMQQKSLKJVUEDS-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H20ClN3O3/c1-23-17-14(3-2-12-13(18)4-6-19-16(12)17)20-15(22)5-7-21-8-10-24-11-9-21/h2-4,6H,5,7-11H2,1H3,(H,20,22).
What are the key properties of N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide?
N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide has a molecular weight of 349.82 g/mol, XLogP of 2.56, 5 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-chloro-8-methoxyquinolin-7-yl)-3-morpholin-4-ylpropanamide is sourced from PubChem (CID 155168942), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).