[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone

C21H19ClN2O2 — CID 42749654

IUPAC[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
SMILESCc1ccc2nc(-c3ccccc3Cl)cc(C(=O)N3CCOCC3)c2c1
InChIInChI=1S/C21H19ClN2O2/c1-14-6-7-19-16(12-14)17(21(25)24-8-10-26-11-9-24)13-20(23-19)15-4-2-3-5-18(15)22/h2-7,12-13H,8-11H2,1H3
InChIKeyMGMFJKWWYJOLFQ-UHFFFAOYSA-N
MW366.85 g/mol
LogP4.34
Rot. Bonds2

About [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone

[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone (PubChem CID 42749654) has the molecular formula C21H19ClN2O2 and a molecular weight of 366.85 g/mol. Its IUPAC name is [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone.

Molecular Properties

Compound Name[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
PubChem CID42749654
Molecular FormulaC21H19ClN2O2
Molecular Weight366.85 g/mol
Exact Mass366.11
IUPAC Name[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
SMILESCc1ccc2nc(-c3ccccc3Cl)cc(C(=O)N3CCOCC3)c2c1
InChIInChI=1S/C21H19ClN2O2/c1-14-6-7-19-16(12-14)17(21(25)24-8-10-26-11-9-24)13-20(23-19)15-4-2-3-5-18(15)22/h2-7,12-13H,8-11H2,1H3
InChIKeyMGMFJKWWYJOLFQ-UHFFFAOYSA-N
XLogP4.34
TPSA42.43 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500366.85
LogP ≤ 54.34
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

[2-(2,5-dimethylphenyl)quinolin-4-yl]-morpholin-4-ylmethanone
CID 899152
[2-(2,3-dihydrofuran-5-yl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
CID 71027528
[2-(2-chlorophenyl)quinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 1023295
[2-(3-methoxyphenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone
CID 42750037
ethyl 4-[2-(2-fluorophenyl)-6-methylquinoline-4-carbonyl]piperazine-1-carboxylate
CID 42749933
2-(2-carboxyphenyl)-6-methylquinoline-4-carboxylic acid
CID 15376151
[2-(2-chlorophenyl)-8-methylquinolin-4-yl]-(4-phenylpiperazin-1-yl)methanone
CID 2220935
[2-(3-chlorophenyl)quinolin-4-yl]-morpholin-4-ylmethanone
CID 1261463
N-butyl-2-(2-chlorophenyl)-6-methylquinoline-4-carboxamide
CID 3625064
2-(2,4-dimethylphenyl)-N-[2-(morpholine-4-carbonyl)phenyl]quinoline-4-carboxamide
CID 55545860
2-(2-chlorophenyl)-6-fluoroquinoline-4-carboxylic acid
CID 3357522
[2-(2,5-dimethoxyphenyl)quinolin-4-yl]-morpholin-4-ylmethanone
CID 35330401

Frequently Asked Questions

What is the IUPAC name of [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The IUPAC name of [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone (CID 42749654) is [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone.
What is the SMILES notation for [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The canonical SMILES for [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone is Cc1ccc2nc(-c3ccccc3Cl)cc(C(=O)N3CCOCC3)c2c1.
What is the InChIKey of [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
The InChIKey is MGMFJKWWYJOLFQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C21H19ClN2O2/c1-14-6-7-19-16(12-14)17(21(25)24-8-10-26-11-9-24)13-20(23-19)15-4-2-3-5-18(15)22/h2-7,12-13H,8-11H2,1H3.
What are the key properties of [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone?
[2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone has a molecular weight of 366.85 g/mol, XLogP of 4.34, 2 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for [2-(2-chlorophenyl)-6-methylquinolin-4-yl]-morpholin-4-ylmethanone is sourced from PubChem (CID 42749654), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).