N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide

C15H18N2O2 — CID 71684039

IUPACN-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1cc2cc(C)ccc2[nH]c1=O
InChIInChI=1S/C15H18N2O2/c1-3-14(18)16-7-6-11-9-12-8-10(2)4-5-13(12)17-15(11)19/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyCKJOBSHOTLROBV-UHFFFAOYSA-N
MW258.32 g/mol
LogP1.91
Rot. Bonds4

About N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide

N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide (PubChem CID 71684039) has the molecular formula C15H18N2O2 and a molecular weight of 258.32 g/mol. Its IUPAC name is N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide.

Molecular Properties

Compound NameN-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
PubChem CID71684039
Molecular FormulaC15H18N2O2
Molecular Weight258.32 g/mol
Exact Mass258.14
IUPAC NameN-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
SMILESCCC(=O)NCCc1cc2cc(C)ccc2[nH]c1=O
InChIInChI=1S/C15H18N2O2/c1-3-14(18)16-7-6-11-9-12-8-10(2)4-5-13(12)17-15(11)19/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,18)(H,17,19)
InChIKeyCKJOBSHOTLROBV-UHFFFAOYSA-N
XLogP1.91
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500258.32
LogP ≤ 51.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-2-(4-methylphenoxy)acetamide
CID 110325904
3-(furan-2-yl)-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide
CID 110413804
4-(4-methoxyphenyl)-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-4-oxobutanamide
CID 110415351
1-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(4-methylphenyl)sulfonylurea
CID 110325909
4-acetamido-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 110662798
N-(2,5-dimethylphenyl)-3-(6-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331255
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(4-methylphenyl)propanamide
CID 110331250
1-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]-3-propylurea
CID 110414626
2-(3-methylphenyl)-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 110662740
3-(dimethylamino)-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzamide
CID 110662792
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(2-piperidin-1-ylethyl)propanamide
CID 53174716
2,5-dimethyl-N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]benzenesulfonamide
CID 110325922

Frequently Asked Questions

What is the IUPAC name of N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide?
The IUPAC name of N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide (CID 71684039) is N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide.
What is the SMILES notation for N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide?
The canonical SMILES for N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide is CCC(=O)NCCc1cc2cc(C)ccc2[nH]c1=O.
What is the InChIKey of N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide?
The InChIKey is CKJOBSHOTLROBV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H18N2O2/c1-3-14(18)16-7-6-11-9-12-8-10(2)4-5-13(12)17-15(11)19/h4-5,8-9H,3,6-7H2,1-2H3,(H,16,18)(H,17,19).
What are the key properties of N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide?
N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide has a molecular weight of 258.32 g/mol, XLogP of 1.91, 4 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(6-methyl-2-oxo-1H-quinolin-3-yl)ethyl]propanamide is sourced from PubChem (CID 71684039), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).