N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide

C23H26N4O2 — CID 167789607

IUPACN-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)c(C)c3ncccc23)cc1NC(=O)CN(C)C
InChIInChI=1S/C23H26N4O2/c1-14-8-9-17(12-20(14)26-21(28)13-27(4)5)25-23(29)19-11-15(2)16(3)22-18(19)7-6-10-24-22/h6-12H,13H2,1-5H3,(H,25,29)(H,26,28)
InChIKeyGFFUIQMRPMUKGY-UHFFFAOYSA-N
MW390.49 g/mol
LogP3.91
Rot. Bonds5

About N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide

N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide (PubChem CID 167789607) has the molecular formula C23H26N4O2 and a molecular weight of 390.49 g/mol. Its IUPAC name is N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide.

Molecular Properties

Compound NameN-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide
PubChem CID167789607
Molecular FormulaC23H26N4O2
Molecular Weight390.49 g/mol
Exact Mass390.21
IUPAC NameN-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide
SMILESCc1ccc(NC(=O)c2cc(C)c(C)c3ncccc23)cc1NC(=O)CN(C)C
InChIInChI=1S/C23H26N4O2/c1-14-8-9-17(12-20(14)26-21(28)13-27(4)5)25-23(29)19-11-15(2)16(3)22-18(19)7-6-10-24-22/h6-12H,13H2,1-5H3,(H,25,29)(H,26,28)
InChIKeyGFFUIQMRPMUKGY-UHFFFAOYSA-N
XLogP3.91
TPSA74.33 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms29
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500390.49
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[4-tert-butyl-3-[[2-(dimethylamino)acetyl]amino]phenyl]-2-fluoropyridine-3-carboxamide
CID 69260763
2-acetamido-N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]acetamide
CID 131890191
N-[3-(carbamothioylamino)-4-methylphenyl]-2-(dimethylamino)acetamide
CID 169356345
2-(dimethylamino)-N-[5-[[1H-imidazol-2-ylmethyl(methyl)carbamoyl]amino]-2-methylphenyl]acetamide
CID 118762994
N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-2-fluoro-6-methoxybenzamide
CID 131933648
N-[5-[[2-(dimethylamino)acetyl]amino]-2-methylphenyl]quinoxaline-2-carboxamide
CID 131912464
N-(7,8-dimethylquinolin-5-yl)-2-pyrrolidin-1-ylacetamide
CID 155953753
N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]cycloheptanecarboxamide
CID 131911889
N-[2-[(7,8-dimethylquinolin-5-yl)amino]-2-oxoethyl]furan-3-carboxamide
CID 75524289
N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-2-(3,5-dimethyl-1,2-oxazol-4-yl)acetamide
CID 131952793
N-[4-methyl-3-(propanoylamino)phenyl]pyridine-4-carboxamide
CID 46761053
N-[5-[[2-(dimethylamino)acetyl]amino]-2-methylphenyl]-2-(1-methylpiperidin-2-yl)acetamide
CID 131938414

Frequently Asked Questions

What is the IUPAC name of N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide?
The IUPAC name of N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide (CID 167789607) is N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide.
What is the SMILES notation for N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide?
The canonical SMILES for N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide is Cc1ccc(NC(=O)c2cc(C)c(C)c3ncccc23)cc1NC(=O)CN(C)C.
What is the InChIKey of N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide?
The InChIKey is GFFUIQMRPMUKGY-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N4O2/c1-14-8-9-17(12-20(14)26-21(28)13-27(4)5)25-23(29)19-11-15(2)16(3)22-18(19)7-6-10-24-22/h6-12H,13H2,1-5H3,(H,25,29)(H,26,28).
What are the key properties of N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide?
N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide has a molecular weight of 390.49 g/mol, XLogP of 3.91, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-[[2-(dimethylamino)acetyl]amino]-4-methylphenyl]-7,8-dimethylquinoline-5-carboxamide is sourced from PubChem (CID 167789607), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).