N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide

C22H24N2O2 — CID 833965

IUPACN-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide
SMILESCCCC(=O)N(Cc1cc2ccccc2[nH]c1=O)c1ccc(C)c(C)c1
InChIInChI=1S/C22H24N2O2/c1-4-7-21(25)24(19-11-10-15(2)16(3)12-19)14-18-13-17-8-5-6-9-20(17)23-22(18)26/h5-6,8-13H,4,7,14H2,1-3H3,(H,23,26)
InChIKeyFCBLEBMPIOIBRQ-UHFFFAOYSA-N
MW348.45 g/mol
LogP4.48
Rot. Bonds5

About N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide

N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide (PubChem CID 833965) has the molecular formula C22H24N2O2 and a molecular weight of 348.45 g/mol. Its IUPAC name is N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide.

Molecular Properties

Compound NameN-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide
PubChem CID833965
Molecular FormulaC22H24N2O2
Molecular Weight348.45 g/mol
Exact Mass348.18
IUPAC NameN-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide
SMILESCCCC(=O)N(Cc1cc2ccccc2[nH]c1=O)c1ccc(C)c(C)c1
InChIInChI=1S/C22H24N2O2/c1-4-7-21(25)24(19-11-10-15(2)16(3)12-19)14-18-13-17-8-5-6-9-20(17)23-22(18)26/h5-6,8-13H,4,7,14H2,1-3H3,(H,23,26)
InChIKeyFCBLEBMPIOIBRQ-UHFFFAOYSA-N
XLogP4.48
TPSA53.17 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds5
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500348.45
LogP ≤ 54.48
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-phenylbutanamide
CID 930092
N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]-N-(3-methylphenyl)butanamide
CID 930030
N-(4-ethoxyphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 1389745
N-(4-methoxyphenyl)-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]butanamide
CID 1312211
4-methyl-N-(4-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1417676
N-(2,4-dimethylphenyl)-N-[(7-methyl-2-oxo-1H-quinolin-3-yl)methyl]butanamide
CID 1017039
N-(3,4-dimethylphenyl)-3-methyl-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1392960
3,4,5-trimethoxy-N-(4-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 4261091
N-ethyl-N-[(2-oxo-1H-quinolin-3-yl)methyl]propanamide
CID 945290
N-[(6-methoxy-2-oxo-1H-quinolin-3-yl)methyl]-N-(2-methoxyphenyl)butanamide
CID 3157383
N-(4-ethoxyphenyl)-2-methoxy-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 1391190
2-methoxy-N-(3-methylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]benzamide
CID 3721115

Frequently Asked Questions

What is the IUPAC name of N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide?
The IUPAC name of N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide (CID 833965) is N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide.
What is the SMILES notation for N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide?
The canonical SMILES for N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide is CCCC(=O)N(Cc1cc2ccccc2[nH]c1=O)c1ccc(C)c(C)c1.
What is the InChIKey of N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide?
The InChIKey is FCBLEBMPIOIBRQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O2/c1-4-7-21(25)24(19-11-10-15(2)16(3)12-19)14-18-13-17-8-5-6-9-20(17)23-22(18)26/h5-6,8-13H,4,7,14H2,1-3H3,(H,23,26).
What are the key properties of N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide?
N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide has a molecular weight of 348.45 g/mol, XLogP of 4.48, 5 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-(3,4-dimethylphenyl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]butanamide is sourced from PubChem (CID 833965), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).