N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide

C24H23N3O2S2 — CID 2395138

IUPACN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc(-c2cccs2)nc2ccccc12
InChIInChI=1S/C24H23N3O2S2/c28-24(25-16-21(23-8-4-14-31-23)27-9-11-29-12-10-27)18-15-20(22-7-3-13-30-22)26-19-6-2-1-5-17(18)19/h1-8,13-15,21H,9-12,16H2,(H,25,28)/t21-/m1/s1
InChIKeyBPERLEJQOVBZRV-OAQYLSRUSA-N
MW449.60 g/mol
LogP4.83
Rot. Bonds6

About N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide

N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide (PubChem CID 2395138) has the molecular formula C24H23N3O2S2 and a molecular weight of 449.60 g/mol. Its IUPAC name is N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide.

Molecular Properties

Compound NameN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
PubChem CID2395138
Molecular FormulaC24H23N3O2S2
Molecular Weight449.60 g/mol
Exact Mass449.12
IUPAC NameN-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
SMILESO=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc(-c2cccs2)nc2ccccc12
InChIInChI=1S/C24H23N3O2S2/c28-24(25-16-21(23-8-4-14-31-23)27-9-11-29-12-10-27)18-15-20(22-7-3-13-30-22)26-19-6-2-1-5-17(18)19/h1-8,13-15,21H,9-12,16H2,(H,25,28)/t21-/m1/s1
InChIKeyBPERLEJQOVBZRV-OAQYLSRUSA-N
XLogP4.83
TPSA54.46 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds6
Heavy Atoms31
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500449.60
LogP ≤ 54.83
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

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Related Compounds

N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-2-pyridin-2-ylquinoline-4-carboxamide
CID 5136979
N-[2-(4-chlorophenyl)-2-pyrrolidin-1-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 146025285
N-[2-(azepan-1-yl)-2-(4-methoxyphenyl)ethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 146025289
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 20899204
2-cyclopropyl-N-(2-pyrrolidin-1-yl-2-thiophen-2-ylethyl)quinoline-4-carboxamide
CID 134014842
2-(dimethylamino)-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 167860438
N-[(4-hydroxypyrrolidin-3-yl)methyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 120946099
N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)pyridine-4-carboxamide
CID 47007223
5-chloro-2-fluoro-N-(2-morpholin-4-yl-2-thiophen-2-ylethyl)benzamide
CID 18148637
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(trifluoromethyl)benzamide
CID 39951261
N-[(2S)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-(tetrazol-1-yl)benzamide
CID 51931032
N-[2-(cyclopropanecarbonylamino)ethyl]-2-thiophen-2-ylquinoline-4-carboxamide
CID 32968803

Frequently Asked Questions

What is the IUPAC name of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide?
The IUPAC name of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide (CID 2395138) is N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide.
What is the SMILES notation for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide?
The canonical SMILES for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide is O=C(NC[C@H](c1cccs1)N1CCOCC1)c1cc(-c2cccs2)nc2ccccc12.
What is the InChIKey of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide?
The InChIKey is BPERLEJQOVBZRV-OAQYLSRUSA-N. The full InChI is InChI=1S/C24H23N3O2S2/c28-24(25-16-21(23-8-4-14-31-23)27-9-11-29-12-10-27)18-15-20(22-7-3-13-30-22)26-19-6-2-1-5-17(18)19/h1-8,13-15,21H,9-12,16H2,(H,25,28)/t21-/m1/s1.
What are the key properties of N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide?
N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide has a molecular weight of 449.60 g/mol, XLogP of 4.83, 6 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2R)-2-morpholin-4-yl-2-thiophen-2-ylethyl]-2-thiophen-2-ylquinoline-4-carboxamide is sourced from PubChem (CID 2395138), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).