N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide

C19H19N3O — CID 20787635

IUPACN-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide
SMILESCC(=O)N(Cc1nc2ccccc2nc1C)c1ccc(C)cc1
InChIInChI=1S/C19H19N3O/c1-13-8-10-16(11-9-13)22(15(3)23)12-19-14(2)20-17-6-4-5-7-18(17)21-19/h4-11H,12H2,1-3H3
InChIKeyQQOUHNPWSSOXOH-UHFFFAOYSA-N
MW305.38 g/mol
LogP3.80
Rot. Bonds3

About N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide

N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide (PubChem CID 20787635) has the molecular formula C19H19N3O and a molecular weight of 305.38 g/mol. Its IUPAC name is N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide.

Molecular Properties

Compound NameN-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide
PubChem CID20787635
Molecular FormulaC19H19N3O
Molecular Weight305.38 g/mol
Exact Mass305.15
IUPAC NameN-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide
SMILESCC(=O)N(Cc1nc2ccccc2nc1C)c1ccc(C)cc1
InChIInChI=1S/C19H19N3O/c1-13-8-10-16(11-9-13)22(15(3)23)12-19-14(2)20-17-6-4-5-7-18(17)21-19/h4-11H,12H2,1-3H3
InChIKeyQQOUHNPWSSOXOH-UHFFFAOYSA-N
XLogP3.80
TPSA46.09 Ų
H-Bond Donors
H-Bond Acceptors3
Rotatable Bonds3
Heavy Atoms23
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.38
LogP ≤ 53.80
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 103

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Related Compounds

N-(4-chlorophenyl)-N-[(3-methylquinoxalin-2-yl)methyl]-2-phenylacetamide
CID 20787643
N-[(4-methylphenyl)methyl]-N-phenylacetamide
CID 10995887
N-methyl-N-[(3-methylquinoxalin-2-yl)methyl]aniline
CID 14474543
N-(4-cyanophenyl)-N-[(5,6-dicyano-3-methylpyrazin-2-yl)methyl]acetamide
CID 1236462
ethane;N-ethyl-N-(4-methylphenyl)acetamide
CID 143607666
4-methyl-N-[(3-methylquinoxalin-2-yl)methyl]aniline
CID 20787666
(3-methylquinoxalin-2-yl)methanamine
CID 69010105
N-(4-methylphenyl)-N-[(2-oxo-1H-quinolin-4-yl)methyl]acetamide
CID 664948
3-(N-acetyl-4-methylanilino)propanamide
CID 21238865
2-N,2-N,4-N,4-N,6-N,6-N-hexakis(4-methylphenyl)-1,3,5-triazine-2,4,6-triamine
CID 23557767
2-methyl-N-[(3-methylquinoxalin-2-yl)methyl]propanamide
CID 110869651
N-[(3-methylquinoxalin-2-yl)methyl]butanamide
CID 110869650

Frequently Asked Questions

What is the IUPAC name of N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide?
The IUPAC name of N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide (CID 20787635) is N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide.
What is the SMILES notation for N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide?
The canonical SMILES for N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide is CC(=O)N(Cc1nc2ccccc2nc1C)c1ccc(C)cc1.
What is the InChIKey of N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide?
The InChIKey is QQOUHNPWSSOXOH-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H19N3O/c1-13-8-10-16(11-9-13)22(15(3)23)12-19-14(2)20-17-6-4-5-7-18(17)21-19/h4-11H,12H2,1-3H3.
What are the key properties of N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide?
N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide has a molecular weight of 305.38 g/mol, XLogP of 3.80, 3 rotatable bonds, 0 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(4-methylphenyl)-N-[(3-methylquinoxalin-2-yl)methyl]acetamide is sourced from PubChem (CID 20787635), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).