N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide

C18H18N4O4 — CID 55759592

IUPACN,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide
SMILESCc1cc(NC(=O)CN(C)C(=O)c2cc(=O)n(C)c3ccccc23)no1
InChIInChI=1S/C18H18N4O4/c1-11-8-15(20-26-11)19-16(23)10-21(2)18(25)13-9-17(24)22(3)14-7-5-4-6-12(13)14/h4-9H,10H2,1-3H3,(H,19,20,23)
InChIKeyLQPHWYFYNUBAOL-UHFFFAOYSA-N
MW354.37 g/mol
LogP1.55
Rot. Bonds4

About N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide

N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide (PubChem CID 55759592) has the molecular formula C18H18N4O4 and a molecular weight of 354.37 g/mol. Its IUPAC name is N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide.

Molecular Properties

Compound NameN,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide
PubChem CID55759592
Molecular FormulaC18H18N4O4
Molecular Weight354.37 g/mol
Exact Mass354.13
IUPAC NameN,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide
SMILESCc1cc(NC(=O)CN(C)C(=O)c2cc(=O)n(C)c3ccccc23)no1
InChIInChI=1S/C18H18N4O4/c1-11-8-15(20-26-11)19-16(23)10-21(2)18(25)13-9-17(24)22(3)14-7-5-4-6-12(13)14/h4-9H,10H2,1-3H3,(H,19,20,23)
InChIKeyLQPHWYFYNUBAOL-UHFFFAOYSA-N
XLogP1.55
TPSA97.44 Ų
H-Bond Donors1
H-Bond Acceptors6
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500354.37
LogP ≤ 51.55
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 106

Analyze N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide with MolForge

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Related Compounds

N-[2-(2-bromoanilino)-2-oxoethyl]-N,1-dimethyl-2-oxoquinoline-4-carboxamide
CID 55755064
N-(5-methyl-1,2-oxazol-3-yl)-1-(1-methyl-2-oxoquinoline-4-carbonyl)piperidine-4-carboxamide
CID 55758260
N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-4-phenylbenzamide
CID 51267288
2-(1,2-dimethylindol-3-yl)-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 110768894
N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-(trifluoromethylsulfanyl)benzamide
CID 55607599
3-amino-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide
CID 60947012
N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-5-thiophen-2-yl-1,2-oxazole-3-carboxamide
CID 51305505
2-[methyl(naphthalen-1-yl)amino]-N-(5-methyl-1,2-oxazol-3-yl)acetamide
CID 60570476
5-chloro-2-methoxy-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide
CID 51267404
[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl] 1-methylindole-3-carboxylate
CID 8816511
5-(ethylsulfamoyl)-N,2-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]benzamide
CID 46469817
3-bromo-N-methyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]pyridine-2-carboxamide
CID 107518559

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide?
The IUPAC name of N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide (CID 55759592) is N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide.
What is the SMILES notation for N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide?
The canonical SMILES for N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide is Cc1cc(NC(=O)CN(C)C(=O)c2cc(=O)n(C)c3ccccc23)no1.
What is the InChIKey of N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide?
The InChIKey is LQPHWYFYNUBAOL-UHFFFAOYSA-N. The full InChI is InChI=1S/C18H18N4O4/c1-11-8-15(20-26-11)19-16(23)10-21(2)18(25)13-9-17(24)22(3)14-7-5-4-6-12(13)14/h4-9H,10H2,1-3H3,(H,19,20,23).
What are the key properties of N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide?
N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide has a molecular weight of 354.37 g/mol, XLogP of 1.55, 4 rotatable bonds, 1 hydrogen bond donors, and 6 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[2-[(5-methyl-1,2-oxazol-3-yl)amino]-2-oxoethyl]-2-oxoquinoline-4-carboxamide is sourced from PubChem (CID 55759592), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).