(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone

C20H25N3O3 — CID 141102111

IUPAC(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone
SMILESCCC1CN(C(=O)c2ccc(OC)nc2OC)c2cc(C)c(C)cc2N1
InChIInChI=1S/C20H25N3O3/c1-6-14-11-23(17-10-13(3)12(2)9-16(17)21-14)20(24)15-7-8-18(25-4)22-19(15)26-5/h7-10,14,21H,6,11H2,1-5H3
InChIKeyQYLQOJOWIQSJKM-UHFFFAOYSA-N
MW355.44 g/mol
LogP3.57
Rot. Bonds4

About (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone

(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone (PubChem CID 141102111) has the molecular formula C20H25N3O3 and a molecular weight of 355.44 g/mol. Its IUPAC name is (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone.

Molecular Properties

Compound Name(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone
PubChem CID141102111
Molecular FormulaC20H25N3O3
Molecular Weight355.44 g/mol
Exact Mass355.19
IUPAC Name(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone
SMILESCCC1CN(C(=O)c2ccc(OC)nc2OC)c2cc(C)c(C)cc2N1
InChIInChI=1S/C20H25N3O3/c1-6-14-11-23(17-10-13(3)12(2)9-16(17)21-14)20(24)15-7-8-18(25-4)22-19(15)26-5/h7-10,14,21H,6,11H2,1-5H3
InChIKeyQYLQOJOWIQSJKM-UHFFFAOYSA-N
XLogP3.57
TPSA63.69 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms26
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500355.44
LogP ≤ 53.57
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

Analyze (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)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

(2-bromo-5-methoxyphenyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone
CID 141102039
(2,3-dimethoxyphenyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone
CID 141102092
[(2S)-2-(cyclohexylmethyl)morpholin-4-yl]-(2,6-dimethoxy-3-pyridinyl)methanone
CID 26396060
(2,6-dimethoxy-3-pyridinyl)-[3-(5-ethyl-1H-1,2,4-triazol-3-yl)piperidin-1-yl]methanone
CID 53192131
ethyl 3-[2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidin-1-yl]-3-oxopropanoate
CID 3867735
[(2S,4R)-2-ethyl-6-methoxy-1,2,3,4-tetrahydro-1,5-naphthyridin-4-yl]carbamic acid
CID 68718148
(2,6-dimethoxy-3-pyridinyl)-[2-(3-propan-2-yl-1H-1,2,4-triazol-5-yl)pyrrolidin-1-yl]methanone
CID 87052077
propyl 2-(2,6-dimethoxypyridine-3-carbonyl)pyrazolidine-1-carboxylate
CID 3845774
2-(2,6-dimethoxypyridine-3-carbonyl)-N-ethylpyrazolidine-1-carbothioamide
CID 3850000
(2,6-dimethoxy-3-pyridinyl)-[(2S)-2-(pyrazol-1-ylmethyl)-1,4-oxazepan-4-yl]methanone
CID 99991440
2,6-dimethoxy-N-(oxan-4-ylmethyl)pyridine-3-carboxamide
CID 91914773
(3S,4R)-1-(2,6-dimethoxypyridine-3-carbonyl)-4-(3-fluorophenyl)pyrrolidine-3-carboxylic acid
CID 70720006

Frequently Asked Questions

What is the IUPAC name of (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone?
The IUPAC name of (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone (CID 141102111) is (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone.
What is the SMILES notation for (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone?
The canonical SMILES for (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone is CCC1CN(C(=O)c2ccc(OC)nc2OC)c2cc(C)c(C)cc2N1.
What is the InChIKey of (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone?
The InChIKey is QYLQOJOWIQSJKM-UHFFFAOYSA-N. The full InChI is InChI=1S/C20H25N3O3/c1-6-14-11-23(17-10-13(3)12(2)9-16(17)21-14)20(24)15-7-8-18(25-4)22-19(15)26-5/h7-10,14,21H,6,11H2,1-5H3.
What are the key properties of (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone?
(2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone has a molecular weight of 355.44 g/mol, XLogP of 3.57, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for (2,6-dimethoxy-3-pyridinyl)-(3-ethyl-6,7-dimethyl-3,4-dihydro-2H-quinoxalin-1-yl)methanone is sourced from PubChem (CID 141102111), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).