N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide

C22H24N2O3 — CID 1458806

IUPACN-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(Cc1cc2c(C)ccc(C)c2[nH]c1=O)C(C)=O
InChIInChI=1S/C22H24N2O3/c1-14-9-10-15(2)21-19(14)11-18(22(26)23-21)13-24(16(3)25)12-17-7-5-6-8-20(17)27-4/h5-11H,12-13H2,1-4H3,(H,23,26)
InChIKeyNSHAQKUKOGSMSH-UHFFFAOYSA-N
MW364.45 g/mol
LogP3.70
Rot. Bonds5

About N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide

N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide (PubChem CID 1458806) has the molecular formula C22H24N2O3 and a molecular weight of 364.45 g/mol. Its IUPAC name is N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide.

Molecular Properties

Compound NameN-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide
PubChem CID1458806
Molecular FormulaC22H24N2O3
Molecular Weight364.45 g/mol
Exact Mass364.18
IUPAC NameN-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide
SMILESCOc1ccccc1CN(Cc1cc2c(C)ccc(C)c2[nH]c1=O)C(C)=O
InChIInChI=1S/C22H24N2O3/c1-14-9-10-15(2)21-19(14)11-18(22(26)23-21)13-24(16(3)25)12-17-7-5-6-8-20(17)27-4/h5-11H,12-13H2,1-4H3,(H,23,26)
InChIKeyNSHAQKUKOGSMSH-UHFFFAOYSA-N
XLogP3.70
TPSA62.40 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500364.45
LogP ≤ 53.70
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3,4-dimethoxy-N-[(2-methoxyphenyl)methyl]benzamide
CID 23997269
N-[(2-methoxyphenyl)methyl]-N-[(6-methyl-2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 1453507
N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]furan-2-carboxamide
CID 3193973
N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]-2-methylbenzamide
CID 3193974
1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-3-(2-methoxyphenyl)-1-[[(2S)-oxolan-2-yl]methyl]urea
CID 1462808
N-[(2-methoxyphenyl)methyl]-N-[(7-oxo-3,6-dihydro-2H-[1,4]dioxino[2,3-g]quinolin-8-yl)methyl]acetamide
CID 1467371
3-[[(1-benzyltetrazol-5-yl)methyl-[(2-methoxyphenyl)methyl]amino]methyl]-5,8-dimethyl-1H-quinolin-2-one
CID 1171252
N-[(7,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-2-fluoro-N-[(2-methoxyphenyl)methyl]benzamide
CID 1453722
2-[acetyl-[(2-methoxyphenyl)methyl]amino]acetic acid
CID 82044282
N-[2-(8-methoxy-5-methyl-2-oxo-1H-quinolin-3-yl)ethyl]-3-(2-methoxyphenyl)propanamide
CID 110602477
ethyl 2-[5-[1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl-[(2-methoxyphenyl)methyl]amino]propyl]tetrazol-1-yl]acetate
CID 3200092
3-(2-chlorophenyl)-1-[2-(3,4-dimethoxyphenyl)ethyl]-1-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]urea
CID 1430319

Frequently Asked Questions

What is the IUPAC name of N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide?
The IUPAC name of N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide (CID 1458806) is N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide.
What is the SMILES notation for N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide?
The canonical SMILES for N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide is COc1ccccc1CN(Cc1cc2c(C)ccc(C)c2[nH]c1=O)C(C)=O.
What is the InChIKey of N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide?
The InChIKey is NSHAQKUKOGSMSH-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H24N2O3/c1-14-9-10-15(2)21-19(14)11-18(22(26)23-21)13-24(16(3)25)12-17-7-5-6-8-20(17)27-4/h5-11H,12-13H2,1-4H3,(H,23,26).
What are the key properties of N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide?
N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide has a molecular weight of 364.45 g/mol, XLogP of 3.70, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(5,8-dimethyl-2-oxo-1H-quinolin-3-yl)methyl]-N-[(2-methoxyphenyl)methyl]acetamide is sourced from PubChem (CID 1458806), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).