N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide

C23H26N2O2 — CID 110410443

IUPACN-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide
SMILESCc1ccc(CC(C)(C)NC(=O)CCc2cc3ccccc3[nH]c2=O)cc1
InChIInChI=1S/C23H26N2O2/c1-16-8-10-17(11-9-16)15-23(2,3)25-21(26)13-12-19-14-18-6-4-5-7-20(18)24-22(19)27/h4-11,14H,12-13,15H2,1-3H3,(H,24,27)(H,25,26)
InChIKeyFJFGOMOCAZOWMG-UHFFFAOYSA-N
MW362.47 g/mol
LogP3.91
Rot. Bonds6

About N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide

N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide (PubChem CID 110410443) has the molecular formula C23H26N2O2 and a molecular weight of 362.47 g/mol. Its IUPAC name is N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide.

Molecular Properties

Compound NameN-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide
PubChem CID110410443
Molecular FormulaC23H26N2O2
Molecular Weight362.47 g/mol
Exact Mass362.20
IUPAC NameN-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide
SMILESCc1ccc(CC(C)(C)NC(=O)CCc2cc3ccccc3[nH]c2=O)cc1
InChIInChI=1S/C23H26N2O2/c1-16-8-10-17(11-9-16)15-23(2,3)25-21(26)13-12-19-14-18-6-4-5-7-20(18)24-22(19)27/h4-11,14H,12-13,15H2,1-3H3,(H,24,27)(H,25,26)
InChIKeyFJFGOMOCAZOWMG-UHFFFAOYSA-N
XLogP3.91
TPSA61.96 Ų
H-Bond Donors2
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500362.47
LogP ≤ 53.91
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 102

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Related Compounds

N-(2-cyanopropan-2-yl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110406225
N-(5-methyl-1,2-oxazol-3-yl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110331051
3-(2-oxo-1H-quinolin-3-yl)-N-(3-phenylpropyl)propanamide
CID 110330993
N-(3-methylbutyl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110330998
N-(2-ethyl-6-methylphenyl)-3-(2-oxo-1H-quinolin-3-yl)propanamide
CID 110355986
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(4-methylphenyl)propanamide
CID 110331250
N-tert-butyl-3-(8-methyl-2-oxo-1H-quinolin-3-yl)propanamide
CID 110331121
2-(3-methylphenyl)-N-[2-(2-oxo-1H-quinolin-3-yl)ethyl]acetamide
CID 110662740
2,2-dimethyl-3-(2-oxo-1H-quinolin-3-yl)propanoic acid
CID 84631810
N-tert-butyl-3-(3-methyl-2-oxo-1H-quinolin-7-yl)propanamide
CID 110390011
2-(3-methyl-2-oxo-1H-quinolin-6-yl)-N-[(2-oxo-1H-quinolin-3-yl)methyl]acetamide
CID 110616680
3-(6-methyl-2-oxo-1H-quinolin-3-yl)-N-(3-methylphenyl)propanamide
CID 110331249

Frequently Asked Questions

What is the IUPAC name of N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide?
The IUPAC name of N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide (CID 110410443) is N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide.
What is the SMILES notation for N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide?
The canonical SMILES for N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide is Cc1ccc(CC(C)(C)NC(=O)CCc2cc3ccccc3[nH]c2=O)cc1.
What is the InChIKey of N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide?
The InChIKey is FJFGOMOCAZOWMG-UHFFFAOYSA-N. The full InChI is InChI=1S/C23H26N2O2/c1-16-8-10-17(11-9-16)15-23(2,3)25-21(26)13-12-19-14-18-6-4-5-7-20(18)24-22(19)27/h4-11,14H,12-13,15H2,1-3H3,(H,24,27)(H,25,26).
What are the key properties of N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide?
N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide has a molecular weight of 362.47 g/mol, XLogP of 3.91, 6 rotatable bonds, 2 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-methyl-1-(4-methylphenyl)propan-2-yl]-3-(2-oxo-1H-quinolin-3-yl)propanamide is sourced from PubChem (CID 110410443), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).