(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone

C14H19N3O2 — CID 103533851

IUPAC(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
SMILESCOC1CCN(C(=O)c2cccc3c2NCCN3)C1
InChIInChI=1S/C14H19N3O2/c1-19-10-5-8-17(9-10)14(18)11-3-2-4-12-13(11)16-7-6-15-12/h2-4,10,15-16H,5-9H2,1H3
InChIKeyVMRLPIXDXBYNET-UHFFFAOYSA-N
MW261.32 g/mol
LogP1.38
Rot. Bonds2

About (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone

(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone (PubChem CID 103533851) has the molecular formula C14H19N3O2 and a molecular weight of 261.32 g/mol. Its IUPAC name is (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone.

Molecular Properties

Compound Name(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
PubChem CID103533851
Molecular FormulaC14H19N3O2
Molecular Weight261.32 g/mol
Exact Mass261.15
IUPAC Name(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
SMILESCOC1CCN(C(=O)c2cccc3c2NCCN3)C1
InChIInChI=1S/C14H19N3O2/c1-19-10-5-8-17(9-10)14(18)11-3-2-4-12-13(11)16-7-6-15-12/h2-4,10,15-16H,5-9H2,1H3
InChIKeyVMRLPIXDXBYNET-UHFFFAOYSA-N
XLogP1.38
TPSA53.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.32
LogP ≤ 51.38
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-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

(4-ethoxypiperidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
CID 104614674
N-[1-(1,2,3,4-tetrahydroquinoxaline-5-carbonyl)pyrrolidin-3-yl]acetamide
CID 104615269
(3,4-dihydroxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
CID 106669665
(3-bromo-2-methylphenyl)-(3-methoxypyrrolidin-1-yl)methanone
CID 103533814
(2-bromo-3-methylphenyl)-(3-methoxypyrrolidin-1-yl)methanone
CID 107982633
[3-(dimethylamino)-4-methylpyrrolidin-1-yl]-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
CID 104615194
[2-fluoro-3-(trifluoromethyl)phenyl]-(3-methoxypyrrolidin-1-yl)methanone
CID 103532722
(3-methoxy-3-methylpiperidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone
CID 107392798
1-methyl-4-(1,2,3,4-tetrahydroquinoxaline-5-carbonyl)piperazin-2-one
CID 104615092
(3-hydroxy-2-methylphenyl)-(4-methoxypiperidin-1-yl)methanone
CID 82829162
(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinolin-2-yl)methanone
CID 103533859
(2-amino-3-pyridinyl)-(3-methoxypiperidin-1-yl)methanone
CID 102969309

Frequently Asked Questions

What is the IUPAC name of (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone?
The IUPAC name of (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone (CID 103533851) is (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone.
What is the SMILES notation for (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone?
The canonical SMILES for (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone is COC1CCN(C(=O)c2cccc3c2NCCN3)C1.
What is the InChIKey of (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone?
The InChIKey is VMRLPIXDXBYNET-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H19N3O2/c1-19-10-5-8-17(9-10)14(18)11-3-2-4-12-13(11)16-7-6-15-12/h2-4,10,15-16H,5-9H2,1H3.
What are the key properties of (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone?
(3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone has a molecular weight of 261.32 g/mol, XLogP of 1.38, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (3-methoxypyrrolidin-1-yl)-(1,2,3,4-tetrahydroquinoxalin-5-yl)methanone is sourced from PubChem (CID 103533851), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).