(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone

C17H18N2O — CID 110715085

IUPAC(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)N2CCN(C)c3ccccc32)cc1
InChIInChI=1S/C17H18N2O/c1-13-7-9-14(10-8-13)17(20)19-12-11-18(2)15-5-3-4-6-16(15)19/h3-10H,11-12H2,1-2H3
InChIKeyLYMJPQQXNFPFLQ-UHFFFAOYSA-N
MW266.34 g/mol
LogP3.09
Rot. Bonds1

About (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone

(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone (PubChem CID 110715085) has the molecular formula C17H18N2O and a molecular weight of 266.34 g/mol. Its IUPAC name is (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone.

Molecular Properties

Compound Name(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone
PubChem CID110715085
Molecular FormulaC17H18N2O
Molecular Weight266.34 g/mol
Exact Mass266.14
IUPAC Name(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone
SMILESCc1ccc(C(=O)N2CCN(C)c3ccccc32)cc1
InChIInChI=1S/C17H18N2O/c1-13-7-9-14(10-8-13)17(20)19-12-11-18(2)15-5-3-4-6-16(15)19/h3-10H,11-12H2,1-2H3
InChIKeyLYMJPQQXNFPFLQ-UHFFFAOYSA-N
XLogP3.09
TPSA23.55 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds1
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500266.34
LogP ≤ 53.09
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

Analyze (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

[4-(methylamino)phenyl]-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 63777193
4-(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)benzonitrile
CID 53013850
(4-methyl-2,3-dihydroquinoxalin-1-yl)-(1-methylpyrazol-4-yl)methanone
CID 110471433
(4-methylphenyl)-[4-(2-pyrrolidin-1-ylethyl)-2,3-dihydroquinoxalin-1-yl]methanone
CID 110361439
(3-iodophenyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 63779175
(3-amino-4-bromophenyl)-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 63776735
(4-methyl-2,3-dihydroquinoxalin-1-yl)-(6-pyrrol-1-yl-3-pyridinyl)methanone
CID 97015667
2,4,6-trimethyl-N-[2-methyl-5-(4-methyl-2,3-dihydroquinoxaline-1-carbonyl)phenyl]benzenesulfonamide
CID 155964407
furan-2-yl-(4-methyl-2,3-dihydroquinoxalin-1-yl)methanone
CID 53013851
(4-methylphenyl)-(2,3,4,5-tetrahydro-1,4-benzodiazepin-1-yl)methanone
CID 63101076
2-bromo-1-(4-methyl-2,3-dihydroquinoxalin-1-yl)ethanone
CID 63778569
(5-methyl-2,3-dihydroindol-1-yl)-(4-methylphenyl)methanone
CID 20793206

Frequently Asked Questions

What is the IUPAC name of (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone?
The IUPAC name of (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone (CID 110715085) is (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone.
What is the SMILES notation for (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone?
The canonical SMILES for (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone is Cc1ccc(C(=O)N2CCN(C)c3ccccc32)cc1.
What is the InChIKey of (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone?
The InChIKey is LYMJPQQXNFPFLQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H18N2O/c1-13-7-9-14(10-8-13)17(20)19-12-11-18(2)15-5-3-4-6-16(15)19/h3-10H,11-12H2,1-2H3.
What are the key properties of (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone?
(4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone has a molecular weight of 266.34 g/mol, XLogP of 3.09, 1 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (4-methyl-2,3-dihydroquinoxalin-1-yl)-(4-methylphenyl)methanone is sourced from PubChem (CID 110715085), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).