6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol

C9H14ClN3O — CID 144746653

IUPAC6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol
SMILESCCO.Clc1ccc2c(n1)NCCN2
InChIInChI=1S/C7H8ClN3.C2H6O/c8-6-2-1-5-7(11-6)10-4-3-9-5;1-2-3/h1-2,9H,3-4H2,(H,10,11);3H,2H2,1H3
InChIKeyMXTIXNYSJVGSHV-UHFFFAOYSA-N
MW215.68 g/mol
LogP1.57
Rot. Bonds

About 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol

6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol (PubChem CID 144746653) has the molecular formula C9H14ClN3O and a molecular weight of 215.68 g/mol. Its IUPAC name is 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol.

Molecular Properties

Compound Name6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol
PubChem CID144746653
Molecular FormulaC9H14ClN3O
Molecular Weight215.68 g/mol
Exact Mass215.08
IUPAC Name6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol
SMILESCCO.Clc1ccc2c(n1)NCCN2
InChIInChI=1S/C7H8ClN3.C2H6O/c8-6-2-1-5-7(11-6)10-4-3-9-5;1-2-3/h1-2,9H,3-4H2,(H,10,11);3H,2H2,1H3
InChIKeyMXTIXNYSJVGSHV-UHFFFAOYSA-N
XLogP1.57
TPSA57.18 Ų
H-Bond Donors3
H-Bond Acceptors4
Rotatable Bonds
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500215.68
LogP ≤ 51.57
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 104

Computed Properties (RDKit)

Structural Alerts{'alert_name': '2-halo_pyridine', 'substructure': 'N/A'}

Analyze 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol 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

7-chloro-2,3,4,5-tetrahydro-1H-pyrido[2,3-b][1,4]diazepine
CID 145087238
6-fluoro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine
CID 131699529
6-chloro-3-ethyl-3-methyl-1,4-dihydropyrido[2,3-b]pyrazin-2-one
CID 115473937
7-chlorospiro[4,5-dihydro-1H-pyrido[2,3-b][1,4]diazepine-3,1'-cyclopentane]-2-one
CID 113316845
ethanol;5-nitroso-2,3-dihydro-1H-indole
CID 19098997
7-chlorospiro[4,5-dihydro-1H-pyrido[2,3-b][1,4]diazepine-3,1'-cyclohexane]-2-one
CID 115473961
6,8-dichloro-1,2,3,4-tetrahydropyrido[2,3-e][1,4]diazepin-5-one
CID 88759960
6-chloro-3-cyclopropyl-3,4-dihydro-1H-pyrido[2,3-b]pyrazin-2-one
CID 115473868
6-chloro-3,3-dimethyl-1,4-dihydropyrido[2,3-b]pyrazin-2-one
CID 19932785
7-chloro-3,3-dimethyl-2,4-dihydro-1H-1,8-naphthyridine
CID 141108596
2-chloro-6,8-dihydro-5H-pyrano[3,4-b]pyridine;methane;propan-1-ol
CID 177205528
4-chloro-5-methylsulfanyl-2,3-dihydro-1H-indole
CID 18940897

Frequently Asked Questions

What is the IUPAC name of 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol?
The IUPAC name of 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol (CID 144746653) is 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol.
What is the SMILES notation for 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol?
The canonical SMILES for 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol is CCO.Clc1ccc2c(n1)NCCN2.
What is the InChIKey of 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol?
The InChIKey is MXTIXNYSJVGSHV-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H8ClN3.C2H6O/c8-6-2-1-5-7(11-6)10-4-3-9-5;1-2-3/h1-2,9H,3-4H2,(H,10,11);3H,2H2,1H3.
What are the key properties of 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol?
6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol has a molecular weight of 215.68 g/mol, XLogP of 1.57, 0 rotatable bonds, 3 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-chloro-1,2,3,4-tetrahydropyrido[2,3-b]pyrazine;ethanol is sourced from PubChem (CID 144746653), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).